Gaussian 16 GINC-GARGANTA LAMSABHI Optimization 14H2OBF3OH CONF223 water EM64L-G16RevC.01 5-Nov-2024 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 48 48 91 91 592 (5D, 7F) 6-311+G(d,p) 138 138 C1[X(BF3H29O15)] C1[X(BF3H29O15)] RB3LYP 6-311+G(d,p) FOpt #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) opt freq 307.7972096 -1 1 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-2.0033,.9472,.9667;-2.0316,1.3243,2.3267;-2.9902,-.0291,.7577;-2.3282,2.0957,.203;-.723,.3908,.5902;2.8807,1.1324,-2.6464;.9354,.1096,3.8046;-2.9269,-2.1813,-1.466;-3.2198,-1.57,-.7812;2.1244,2.1244,1.7358;1.6079,1.7404,2.476;-2.6033,-2.9697,-.9709;1.5259,2.7759,1.3217;3.2741,.273,-2.4648;2.6337,-.3699,-2.8437;.6567,1.0515,3.8138;-.2265,1.0556,3.4292;1.1472,-1.7267,1.0112;.3607,-1.1591,.9331;1.887,-1.1389,.6911;-1.3821,1.8409,-2.7716;-1.8915,2.1141,-2.0005;-1.2289,.885,-2.6178;3.0356,-.0337,.285;3.0767,.1261,-.6802;2.7041,.7909,.7002;.6134,-3.7535,-.7017;.8436,-3.0269,-.0787;.426,-3.2997,-1.529;-.7351,-.7407,-2.0509;-.5357,-.4142,-1.156;-1.5232,-1.325,-1.9185;-1.9659,-4.321,-.1013;-1.0085,-4.1687,-.2763;-2.1892,-5.0876,-.6382;.4261,3.9658,.4589;.6339,3.5673,-.4132;-.4604,3.6458,.6525;1.5269,-1.5462,3.706;1.4012,-1.6808,2.7409;2.4785,-1.4454,3.8081;1.4634,-1.4849,-3.4895;.6639,-1.2832,-2.9582;1.7573,-2.3456,-3.1768;1.0688,2.5757,-1.8103;.2014,2.3501,-2.2182;.0015,1.0102,.7346;1.2832,1.7961,-1.2862; g16 /usr/local/gaussian/gaussian16/g16/l1.exe "/temporal/lamsabhi/opt-b3lyp.gjf-6521626/Gau-449264.inp" -scrdir="/temporal/lamsabhi/opt-b3lyp.gjf-6521626/" chk=/home/lamsabhi/diver/BF3-H2O/14H2OBF3OH/water/CONF223/opt-b3lyp.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Wate 1/18=20,19=15,26=3,38=1/1,3 2/9=110,12=2,17=6,18=5,40=1/2 3/5=4,6=6,7=111,11=2,25=1,30=1,70=32201,71=1,72=1,74=-5,124=41/1,2,3 4//1 5/5=2,38=5,53=1/2 6/7=2,8=2,9=2,10=2,28=1/1 7//1,2,3,16 1/18=20,19=15,26=3/3(2) 2/9=110/2 99//99 2/9=110/2 3/5=4,6=6,7=111,11=2,25=1,30=1,70=32205,71=1,72=1,74=-5,124=41/1,2,3 4/5=5,16=3,69=1/1 5/5=2,38=5,53=1/2 7//1,2,3,16 1/18=20,19=15,26=3/3(-5) 2/9=110/2 6/7=2,8=2,9=2,10=2,19=2,28=1/1 99/9=1/99 Optimization 14H2OBF3OH CONF223 water 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 11 19 19 19 16 1 1 16 1 16 1 1 1 16 1 16 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 1 11.0093053 18.9984033 18.9984033 18.9984033 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 3 1 1 1 0 1 1 0 1 0 1 1 1 0 1 0 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 1 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 R51 1 1 1 1 5 5 5 6 7 7 8 8 8 10 10 10 11 12 13 14 14 15 16 18 18 18 18 20 21 21 21 23 24 24 27 27 27 30 30 30 33 33 36 36 37 39 39 42 42 45 45 2 3 4 5 19 31 47 14 16 39 9 12 32 11 13 26 16 33 36 15 25 42 17 19 20 28 40 24 22 23 46 30 25 26 28 29 34 31 32 43 34 35 37 38 45 40 41 43 44 46 48 1.4115 1.4039 1.417 1.4459 1.922 1.9319 0.9641 0.9625 0.9822 1.7611 0.9635 0.9856 1.7054 0.9808 0.9767 1.7852 1.7802 1.7287 1.8358 0.9834 1.8014 1.7406 0.9634 0.973 0.9976 1.7236 1.7489 1.6449 0.9636 0.9802 1.753 1.7911 0.9792 0.981 0.9844 0.962 1.7273 0.9733 0.99 1.7535 0.9851 0.9622 0.9811 0.9622 1.7676 0.9825 0.9624 0.9809 0.9618 0.9846 0.9636 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 2 2 2 3 3 4 1 1 1 19 19 31 9 9 12 11 11 13 6 6 15 7 7 11 19 19 19 20 20 28 5 22 22 23 20 20 25 28 28 29 23 23 23 31 31 32 5 12 12 34 13 13 37 7 7 40 15 15 43 37 37 46 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 10 10 10 14 14 14 16 16 16 18 18 18 18 18 18 19 21 21 21 24 24 24 27 27 27 30 30 30 30 30 30 31 33 33 33 36 36 36 39 39 39 42 42 42 45 45 45 3 4 5 4 5 5 19 31 47 31 47 47 12 32 32 13 26 26 15 25 25 11 17 17 20 28 40 28 40 40 18 23 46 46 25 26 26 29 34 34 31 32 43 32 43 43 30 34 35 35 37 38 38 40 41 41 43 44 44 46 48 48 108.3719 107.3464 111.8037 108.7987 108.4249 111.9988 139.7406 118.7877 112.2836 76.7387 93.8804 109.2827 104.4973 96.9026 105.345 104.9779 108.4397 116.8217 104.172 102.412 104.8965 102.2687 105.0976 100.8482 103.301 104.2949 100.4564 111.8488 101.1985 132.126 160.12 103.5047 98.1925 95.3136 112.475 102.9588 107.109 103.9857 103.9587 98.1823 92.4648 111.0142 109.6949 103.7793 114.5872 121.4467 161.9943 98.5181 104.866 104.4497 91.5799 103.9938 103.8259 98.0949 103.1612 104.1858 102.4359 104.3117 104.898 103.8386 94.5126 103.6453 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 A92 A93 A94 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 21 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 21 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 46 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 46 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 45 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 45 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 1 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 180.7688 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 179.5659 178.8635 179.9589 178.4007 175.4923 172.3254 183.9095 179.8958 180.5609 170.7909 175.8628 173.4228 175.0118 174.8621 173.4804 175.8361 180.3399 182.3622 183.0692 179.5985 174.7979 189.4759 175.0961 190.7689 183.6375 179.6196 174.8864 188.5219 184.1093 183.6165 178.0718 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 2 2 2 3 3 3 4 4 4 1 31 47 1 19 47 9 9 9 12 12 12 9 9 32 32 13 13 26 26 11 11 13 13 11 11 26 26 6 6 15 15 6 6 25 25 11 11 17 17 20 28 40 19 19 28 28 40 40 19 19 20 20 40 40 19 19 20 20 28 28 22 22 22 46 46 46 22 22 23 23 28 28 29 29 23 32 43 23 23 31 31 32 32 13 13 38 38 1 1 1 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 8 8 8 8 8 8 8 10 10 10 10 10 10 10 10 10 10 10 10 14 14 14 14 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 21 21 21 21 21 21 21 21 21 21 27 27 27 27 30 30 30 30 30 30 30 30 30 36 36 36 36 5 5 5 5 5 5 5 5 5 19 19 19 31 31 31 30 30 30 30 30 30 33 33 33 33 16 16 16 16 24 24 24 24 36 36 36 36 24 24 24 24 42 42 42 42 39 39 39 39 19 19 19 24 24 24 24 24 24 27 27 27 27 27 27 39 39 39 39 39 39 30 30 30 30 30 30 45 45 45 45 33 33 33 33 31 31 31 42 42 42 42 42 42 45 45 45 45 19 31 47 19 31 47 19 31 47 18 18 18 30 30 30 23 31 43 23 31 43 34 35 34 35 7 17 7 17 20 25 20 25 37 38 37 38 20 26 20 26 43 44 43 44 40 41 40 41 5 5 5 25 26 25 26 25 26 29 34 29 34 29 34 7 41 7 41 7 41 31 32 43 31 32 43 37 48 37 48 12 35 12 35 5 5 5 15 44 15 44 15 44 46 48 46 48 67.6047 171.7177 -59.0563 -51.807 52.3061 -178.4679 -171.8675 -67.7545 61.4715 -156.5791 84.2586 -24.6506 -0.8784 139.0374 -131.4664 -61.0884 34.54 163.9738 -167.2349 -71.6065 57.8273 -107.6093 145.0495 -6.588 -113.9292 143.0414 34.8108 17.5992 -90.6314 25.1547 145.0343 -92.8242 27.0555 -130.2909 -25.8652 -10.3035 94.1222 107.288 -7.2128 -1.9312 -116.432 -60.9168 -169.9514 45.9058 -63.1288 -49.2538 57.0351 55.121 161.4099 -2.7988 -119.8556 101.4754 -76.1909 37.9561 35.455 149.602 -178.6142 -64.4673 54.2776 -47.2593 -56.3745 -157.9114 171.9595 70.4226 -33.0454 -137.7587 72.2619 -32.4514 -153.1231 102.1635 -43.1051 61.3026 -158.7961 54.9884 159.3962 -60.7026 -13.2039 83.6377 -117.2972 -20.4556 78.6686 -174.6161 -27.3332 79.3821 58.8547 -53.4866 171.85 69.3956 178.2503 -31.707 77.1477 -159.3031 -50.4483 128.0341 23.7318 24.6947 -79.6076 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 0.10000e-02 0.10000e-05 F 611 A 592 A 916 611 2058.0096541248 48 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=141 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 592 RedAO= T EigKep= 8.01D-05 NBF= 592 NBsUse= 592 1.00D-06 EigRej= -1.00D+00 NBFU= 592 Berny optimization. local minimum Step number 64 out of a maximum of 252 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00050 0.00105 0.00143 0.00210 0.00266 0.00275 0.00305 0.00349 0.00354 0.00437 0.00449 0.00477 0.00499 0.00568 0.00640 0.00715 0.00775 0.00816 0.00898 0.01004 0.01081 0.01240 0.01327 0.01349 0.01437 0.01724 0.01754 0.01937 0.01978 0.02045 0.02169 0.02387 0.02659 0.02789 0.02966 0.03039 0.03103 0.03384 0.03504 0.03718 0.03796 0.04130 0.04263 0.04438 0.04619 0.04749 0.04986 0.05181 0.05278 0.05389 0.05482 0.05644 0.05714 0.05860 0.05884 0.06063 0.06190 0.06314 0.06361 0.06411 0.06463 0.06542 0.06798 0.06864 0.06895 0.07023 0.07173 0.07260 0.07325 0.07441 0.07587 0.07663 0.07811 0.07858 0.08168 0.08212 0.08388 0.08434 0.08670 0.08737 0.08922 0.09223 0.09247 0.09438 0.09583 0.09820 0.10233 0.10877 0.11036 0.11595 0.11884 0.12201 0.13023 0.13827 0.14457 0.15610 0.17043 0.18963 0.20717 0.22415 0.26490 0.28719 0.32711 0.33991 0.36037 0.40670 0.42546 0.43321 0.44456 0.46602 0.47763 0.48305 0.48942 0.49290 0.49772 0.49885 0.50286 0.50491 0.50666 0.51011 0.51148 0.51381 0.51811 0.52529 0.53165 0.53847 0.54507 0.54758 0.54879 0.54985 0.55058 0.55152 0.55228 0.55747 0.57028 0.57923 0.59824 0.77786 -1.75788384e-07 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 R51 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 A92 A93 A94 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 2.70148 2.68054 2.73690 2.70079 3.48296 3.44557 1.84975 1.84673 1.85807 3.39408 1.83378 1.85711 3.42852 1.86030 1.84816 3.52505 3.38745 3.38936 3.58605 1.85506 3.45236 3.41556 1.83471 1.85040 1.86533 3.32591 3.38415 3.36238 1.83414 1.85316 3.40261 3.47228 1.85593 1.84476 1.86326 1.82468 3.34900 1.85456 1.85765 3.30923 1.86185 1.82374 1.83573 1.83487 3.98117 1.85952 1.82378 1.86238 1.82375 1.86042 1.82772 1.88807 1.85334 1.97154 1.87664 1.91794 1.95227 2.39083 2.04177 1.95669 1.36960 1.62577 2.00739 1.83005 1.59172 1.84462 1.85215 1.99978 2.42434 1.82972 1.64477 1.73402 1.78973 1.82914 1.63203 1.79464 1.80180 1.70859 1.94801 1.78002 2.34888 2.80153 1.80216 1.70318 1.65566 1.97674 1.69740 1.83152 1.82289 1.84890 1.76257 1.53171 1.88967 2.04041 1.80472 2.01271 2.09371 2.93246 1.70574 1.93717 1.83621 1.57604 1.65699 1.80853 1.77309 1.91423 1.83509 1.72749 1.82594 1.83994 1.53408 1.37063 1.81765 3.11568 2.95458 3.11641 2.94059 3.07693 2.98255 2.91951 3.08402 3.02675 3.18203 2.87534 3.04089 2.67699 3.01617 3.01830 3.03321 3.08891 3.06940 3.23032 3.36504 3.20528 3.03019 3.33566 3.18960 3.27226 3.18840 3.14716 3.07416 3.44906 3.15564 3.23755 3.15743 1.13537 2.92491 -0.98504 -0.97480 0.81475 -3.09521 -3.05782 -1.26828 1.10495 -2.73170 1.50244 -0.50290 -0.02684 2.36747 -2.37822 -1.10517 0.44448 2.67137 -2.92514 -1.37550 0.85139 -1.70337 2.67708 -0.05172 -1.95446 2.83764 1.00283 -0.10792 -1.94274 0.86491 2.87594 -2.06782 -0.05679 -2.95207 -1.14444 -0.15775 1.64988 1.61411 -0.19203 -0.22805 -2.03419 -0.58963 -2.47518 1.08586 -0.79970 -0.62440 1.30226 1.05858 2.98524 -0.07534 -2.10352 1.74465 -1.33513 0.55215 0.56632 2.45361 -3.06597 -1.17868 0.98068 -0.86439 -0.93763 -2.78270 2.97462 1.12955 -0.55300 -2.53629 1.26893 -0.71437 -2.56716 1.73273 -0.60629 1.16345 -2.60557 1.09245 2.86220 -0.90682 -0.56545 0.78640 -2.37740 -1.02555 1.29397 -3.01239 -0.58614 1.39069 1.02352 -0.86584 3.09784 0.94714 2.82614 -0.78589 1.09311 -3.00885 -1.12985 2.16121 0.30938 0.51583 -1.33599 -0.00002 0.00004 0.00000 -0.00001 -0.00001 0.00003 0.00001 0.00000 0.00000 0.00000 0.00001 0.00000 -0.00000 0.00002 -0.00000 0.00001 -0.00001 0.00001 0.00000 0.00001 0.00001 -0.00001 0.00001 0.00001 -0.00002 -0.00000 -0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00002 -0.00002 -0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 0.00002 0.00001 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00001 0.00000 0.00000 0.00000 -0.00000 -0.00001 0.00000 -0.00001 -0.00000 0.00002 0.00000 -0.00001 0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00002 -0.00001 -0.00002 -0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 -0.00000 0.00001 -0.00000 0.00001 0.00000 -0.00001 -0.00001 -0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00002 -0.00000 0.00001 0.00000 0.00001 -0.00000 -0.00000 -0.00001 0.00000 0.00000 -0.00001 0.00000 0.00000 -0.00002 -0.00001 -0.00001 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00001 -0.00001 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00002 0.00001 -0.00000 -0.00001 0.00000 0.00001 -0.00001 -0.00001 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00001 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00001 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 0.00000 -0.00001 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00001 0.00001 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00001 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00001 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00006 -0.00027 0.00003 0.00016 -0.00006 0.00010 -0.00002 0.00003 0.00002 -0.00016 -0.00002 -0.00002 0.00017 -0.00003 -0.00004 0.00017 0.00044 -0.00001 0.00060 -0.00001 -0.00065 0.00020 -0.00002 0.00001 -0.00003 -0.00016 -0.00008 0.00030 -0.00001 0.00001 -0.00009 -0.00033 0.00006 -0.00002 0.00002 0.00000 -0.00014 0.00002 0.00000 0.00041 0.00003 0.00002 -0.00003 -0.00001 0.00153 0.00000 -0.00000 -0.00003 0.00000 0.00003 0.00001 0.00010 -0.00001 -0.00014 0.00006 0.00005 -0.00005 0.00010 -0.00013 -0.00010 0.00006 0.00022 -0.00009 0.00002 0.00002 0.00005 0.00001 -0.00005 0.00001 -0.00002 -0.00006 -0.00005 0.00008 0.00005 0.00024 0.00009 0.00007 0.00007 0.00013 -0.00006 -0.00021 0.00002 0.00002 -0.00011 -0.00010 0.00001 -0.00006 -0.00002 -0.00001 -0.00016 0.00042 0.00005 0.00015 0.00006 -0.00004 -0.00018 -0.00003 -0.00001 0.00028 0.00008 -0.00005 0.00082 0.00018 0.00003 0.00010 -0.00011 0.00007 -0.00005 0.00002 0.00001 -0.00035 -0.00034 -0.00005 0.00017 -0.00018 -0.00010 -0.00005 0.00006 -0.00004 0.00005 0.00006 0.00007 0.00010 -0.00007 -0.00006 -0.00067 -0.00045 -0.00004 0.00002 -0.00006 0.00001 0.00022 0.00021 -0.00016 0.00013 -0.00023 -0.00006 0.00009 -0.00028 -0.00004 0.00003 0.00081 -0.00008 0.00022 -0.00003 0.00023 0.00024 -0.00015 0.00016 0.00017 -0.00023 0.00008 0.00009 -0.00030 -0.00062 -0.00052 -0.00039 0.00046 0.00057 0.00087 0.00013 0.00016 -0.00021 0.00011 0.00015 -0.00022 -0.00007 -0.00014 -0.00008 -0.00015 -0.00015 -0.00025 0.00016 0.00006 -0.00016 -0.00016 0.00015 0.00015 -0.00004 -0.00001 -0.00042 -0.00039 -0.00011 -0.00007 -0.00008 -0.00004 0.00001 -0.00001 -0.00005 -0.00007 -0.00005 0.00003 0.00025 0.00034 0.00067 0.00047 0.00064 -0.00010 -0.00015 0.00002 -0.00003 -0.00018 -0.00024 0.00067 0.00019 0.00044 -0.00003 0.00079 0.00031 0.00012 0.00020 0.00019 0.00027 0.00022 0.00030 0.00026 0.00025 0.00041 0.00016 0.00015 0.00031 -0.00021 -0.00062 -0.00021 -0.00062 -0.00012 0.00006 -0.00021 -0.00003 -0.00035 -0.00051 -0.00029 -0.00012 -0.00009 -0.00012 -0.00008 0.00010 0.00014 0.00005 -0.00010 -0.00017 -0.00032 -0.00005 0.00018 0.00001 -0.00009 -0.00005 0.00044 0.00003 -0.00001 -0.00001 0.00019 0.00002 -0.00001 -0.00001 0.00005 0.00001 0.00012 -0.00044 0.00023 -0.00030 0.00002 0.00055 -0.00023 0.00001 0.00001 -0.00002 0.00010 -0.00017 0.00002 0.00000 0.00001 0.00017 -0.00010 -0.00006 -0.00000 -0.00001 0.00000 -0.00004 -0.00003 0.00002 -0.00000 0.00000 -0.00000 0.00001 0.00000 0.00008 0.00002 0.00000 -0.00000 0.00000 -0.00001 0.00001 -0.00003 -0.00000 0.00007 -0.00007 -0.00003 0.00006 0.00002 -0.00002 0.00005 0.00004 -0.00008 -0.00004 -0.00004 -0.00008 -0.00004 0.00010 -0.00006 -0.00001 -0.00000 -0.00001 0.00022 -0.00023 -0.00001 -0.00022 0.00004 0.00007 -0.00015 0.00011 -0.00002 -0.00006 0.00000 -0.00001 0.00006 0.00003 0.00007 0.00007 0.00001 -0.00001 0.00001 -0.00009 -0.00008 0.00002 0.00010 -0.00006 -0.00003 -0.00000 0.00004 -0.00008 0.00007 0.00004 -0.00004 -0.00006 -0.00000 -0.00020 0.00002 -0.00003 -0.00000 -0.00004 -0.00001 -0.00024 -0.00025 -0.00001 0.00001 0.00004 0.00005 0.00003 -0.00005 0.00000 0.00005 -0.00028 -0.00020 -0.00009 -0.00004 -0.00006 0.00027 0.00027 0.00007 -0.00003 0.00030 0.00016 -0.00019 -0.00005 0.00010 0.00008 -0.00004 -0.00008 0.00011 0.00006 -0.00006 0.00010 0.00008 0.00006 -0.00002 -0.00010 -0.00009 -0.00003 -0.00006 -0.00007 -0.00001 -0.00003 -0.00001 0.00006 0.00003 0.00000 -0.00002 0.00000 0.00024 0.00028 0.00023 0.00016 0.00005 -0.00009 0.00022 0.00012 -0.00003 -0.00000 -0.00005 -0.00007 -0.00012 0.00002 0.00009 -0.00025 -0.00018 0.00011 0.00017 -0.00015 -0.00009 0.00008 0.00008 0.00039 0.00039 0.00006 0.00004 0.00006 0.00004 0.00007 0.00010 0.00010 0.00013 0.00005 -0.00002 -0.00021 -0.00028 0.00011 -0.00005 0.00007 -0.00017 -0.00011 -0.00005 0.00001 -0.00003 0.00003 -0.00005 0.00007 -0.00015 -0.00003 -0.00024 -0.00012 -0.00017 -0.00011 -0.00015 -0.00010 -0.00016 -0.00010 0.00005 -0.00004 0.00010 0.00012 0.00003 0.00017 -0.00002 -0.00031 -0.00002 -0.00031 0.00007 0.00014 0.00011 0.00018 -0.00025 -0.00026 -0.00018 -0.00020 -0.00023 -0.00016 -0.00020 -0.00003 -0.00007 -0.00005 -0.00014 0.00008 -0.00001 0.00000 -0.00009 0.00004 0.00007 -0.00011 0.00054 0.00001 0.00002 0.00001 0.00003 -0.00000 -0.00003 0.00016 0.00002 -0.00003 0.00029 0.00000 0.00022 0.00031 0.00001 -0.00011 -0.00002 -0.00000 0.00002 -0.00005 -0.00006 -0.00025 0.00032 -0.00001 0.00002 0.00007 -0.00043 0.00001 -0.00002 0.00001 0.00001 -0.00018 -0.00001 0.00002 0.00041 0.00003 0.00001 -0.00003 -0.00000 0.00161 0.00002 -0.00000 -0.00003 0.00000 0.00002 0.00002 0.00007 -0.00002 -0.00007 -0.00001 0.00002 0.00002 0.00012 -0.00015 -0.00005 0.00010 0.00015 -0.00013 -0.00002 -0.00006 0.00001 0.00011 -0.00011 -0.00000 -0.00002 -0.00008 0.00017 -0.00015 0.00004 0.00002 0.00013 0.00013 -0.00008 0.00024 -0.00008 -0.00027 0.00002 0.00001 -0.00005 -0.00007 0.00008 0.00001 -0.00001 -0.00002 -0.00015 0.00033 -0.00003 0.00017 0.00016 -0.00009 -0.00021 -0.00004 0.00003 0.00020 0.00015 -0.00001 0.00078 0.00012 0.00002 -0.00010 -0.00009 0.00005 -0.00005 -0.00002 0.00000 -0.00060 -0.00059 -0.00005 0.00018 -0.00014 -0.00005 -0.00003 0.00001 -0.00004 0.00009 -0.00022 -0.00013 0.00001 -0.00011 -0.00012 -0.00040 -0.00018 0.00002 -0.00001 0.00024 0.00017 0.00003 0.00015 -0.00006 0.00021 -0.00027 -0.00015 0.00020 -0.00022 -0.00010 0.00013 0.00090 -0.00002 0.00020 -0.00013 0.00014 0.00021 -0.00021 0.00008 0.00016 -0.00026 0.00008 0.00015 -0.00027 -0.00062 -0.00054 -0.00038 0.00069 0.00085 0.00109 0.00028 0.00022 -0.00030 0.00033 0.00027 -0.00025 -0.00007 -0.00019 -0.00015 -0.00027 -0.00013 -0.00016 -0.00009 -0.00012 -0.00005 0.00001 -0.00001 0.00005 0.00004 0.00007 -0.00003 -0.00001 -0.00005 -0.00003 -0.00002 0.00000 0.00008 0.00009 0.00005 0.00006 -0.00000 0.00001 0.00004 0.00006 0.00078 0.00042 0.00071 -0.00027 -0.00026 -0.00002 -0.00002 -0.00021 -0.00021 0.00063 0.00027 0.00029 -0.00006 0.00054 0.00019 -0.00005 0.00009 0.00004 0.00018 0.00006 0.00020 0.00031 0.00021 0.00051 0.00028 0.00018 0.00048 -0.00023 -0.00093 -0.00022 -0.00092 -0.00006 0.00020 -0.00010 0.00015 -0.00060 -0.00077 -0.00048 -0.00032 -0.00032 -0.00028 -0.00028 0.00007 0.00007 0.00001 -0.00024 -0.00009 -0.00033 2.70149 2.68045 2.73695 2.70086 3.48285 3.44612 1.84976 1.84676 1.85809 3.39411 1.83378 1.85708 3.42868 1.86032 1.84812 3.52534 3.38745 3.38959 3.58635 1.85507 3.45226 3.41554 1.83471 1.85042 1.86529 3.32584 3.38390 3.36270 1.83413 1.85318 3.40269 3.47185 1.85594 1.84474 1.86328 1.82469 3.34882 1.85455 1.85767 3.30963 1.86188 1.82375 1.83570 1.83487 3.98278 1.85954 1.82378 1.86235 1.82376 1.86044 1.82773 1.88814 1.85332 1.97147 1.87663 1.91796 1.95229 2.39095 2.04162 1.95665 1.36970 1.62591 2.00727 1.83003 1.59166 1.84463 1.85226 1.99967 2.42434 1.82969 1.64469 1.73420 1.78957 1.82918 1.63205 1.79476 1.80194 1.70851 1.94825 1.77994 2.34861 2.80156 1.80217 1.70313 1.65560 1.97683 1.69741 1.83151 1.82287 1.84876 1.76290 1.53167 1.88984 2.04058 1.80463 2.01250 2.09368 2.93249 1.70594 1.93732 1.83620 1.57682 1.65711 1.80855 1.77298 1.91415 1.83513 1.72744 1.82592 1.83994 1.53348 1.37004 1.81759 3.11585 2.95444 3.11636 2.94057 3.07694 2.98251 2.91960 3.08380 3.02662 3.18204 2.87523 3.04077 2.67659 3.01599 3.01832 3.03320 3.08915 3.06957 3.23035 3.36520 3.20522 3.03040 3.33539 3.18946 3.27246 3.18818 3.14706 3.07430 3.44996 3.15562 3.23775 3.15730 1.13551 2.92512 -0.98525 -0.97471 0.81490 -3.09547 -3.05775 -1.26813 1.10468 -2.73232 1.50189 -0.50328 -0.02614 2.36832 -2.37713 -1.10488 0.44470 2.67106 -2.92481 -1.37523 0.85114 -1.70344 2.67688 -0.05187 -1.95473 2.83751 1.00267 -0.10801 -1.94286 0.86486 2.87595 -2.06782 -0.05674 -2.95203 -1.14437 -0.15779 1.64988 1.61406 -0.19206 -0.22807 -2.03418 -0.58954 -2.47509 1.08591 -0.79963 -0.62441 1.30227 1.05862 2.98530 -0.07455 -2.10310 1.74536 -1.33540 0.55189 0.56630 2.45359 -3.06618 -1.17889 0.98130 -0.86412 -0.93734 -2.78277 2.97516 1.12973 -0.55304 -2.53620 1.26896 -0.71419 -2.56710 1.73293 -0.60599 1.16366 -2.60505 1.09273 2.86238 -0.90634 -0.56568 0.78548 -2.37763 -1.02647 1.29391 -3.01219 -0.58624 1.39084 1.02291 -0.86661 3.09736 0.94682 2.82582 -0.78617 1.09283 -3.00877 -1.12978 2.16121 0.30914 0.51574 -1.33633 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000044 0.000007 0.001253 0.000279 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -8.588647e-08 Optimization completed. -- Stationary point found. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 R51 1 1 1 1 5 5 5 6 7 7 8 8 8 10 10 10 11 12 13 14 14 15 16 18 18 18 18 20 21 21 21 23 24 24 27 27 27 30 30 30 33 33 36 36 37 39 39 42 42 45 45 2 3 4 5 19 31 47 14 16 39 9 12 32 11 13 26 16 33 36 15 25 42 17 19 20 28 40 24 22 23 46 30 25 26 28 29 34 31 32 43 34 35 37 38 45 40 41 43 44 46 48 1.4296 1.4185 1.4483 1.4292 1.8431 1.8233 0.9788 0.9772 0.9833 1.7961 0.9704 0.9827 1.8143 0.9844 0.978 1.8654 1.7926 1.7936 1.8977 0.9817 1.8269 1.8074 0.9709 0.9792 0.9871 1.76 1.7908 1.7793 0.9706 0.9806 1.8006 1.8375 0.9821 0.9762 0.986 0.9656 1.7722 0.9814 0.983 1.7512 0.9852 0.9651 0.9714 0.971 2.1067 0.984 0.9651 0.9855 0.9651 0.9845 0.9672 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 2 2 2 3 3 4 1 1 1 19 19 31 9 9 12 11 11 13 6 6 15 7 7 11 19 19 19 20 20 28 5 22 22 23 20 20 25 28 28 29 23 23 23 31 31 32 5 12 12 34 13 13 37 7 7 40 15 15 43 37 37 46 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 10 10 10 14 14 14 16 16 16 18 18 18 18 18 18 19 21 21 21 24 24 24 27 27 27 30 30 30 30 30 30 31 33 33 33 36 36 36 39 39 39 42 42 42 45 45 45 3 4 5 4 5 5 19 31 47 31 47 47 12 32 32 13 26 26 15 25 25 11 17 17 20 28 40 28 40 40 18 23 46 46 25 26 26 29 34 34 31 32 43 32 43 43 30 34 35 35 37 38 38 40 41 41 43 44 44 46 48 48 108.1784 106.1886 112.9609 107.5234 109.8899 111.857 136.9845 116.9846 112.1102 78.4721 93.1496 115.0151 104.8542 91.1987 105.6889 106.1204 114.5787 138.9044 104.835 94.2382 99.3522 102.5438 104.8018 93.5083 102.8251 103.2357 97.8948 111.6127 101.9874 134.5811 160.5161 103.2561 97.5852 94.8625 113.2591 97.2541 104.9385 104.4439 105.9344 100.9881 87.7603 108.2701 116.9071 103.4031 115.3196 119.961 168.0175 97.7319 110.9917 105.2072 90.3005 94.9387 103.6211 101.5904 109.6775 105.1426 98.9776 104.6184 105.4206 87.8964 78.5315 104.1434 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 A92 A93 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 21 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 46 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 45 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 1 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 178.5151 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 169.285 178.557 168.4836 176.2949 170.8875 167.2754 176.7013 173.4201 182.3171 164.7446 174.2304 153.3803 172.8139 172.9356 173.7903 176.9813 175.8639 185.0838 192.8029 183.6489 173.6171 191.1194 182.7508 187.4869 182.6819 180.319 176.1366 197.6167 180.8049 185.4982 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 2 2 2 3 3 3 4 4 4 1 31 47 1 19 47 9 9 9 12 12 12 9 9 32 32 13 13 26 26 11 11 13 13 11 11 26 26 6 6 15 15 6 6 25 25 11 11 17 17 20 28 40 19 19 28 28 40 40 19 19 20 20 40 40 19 19 20 20 28 28 22 22 22 46 46 46 22 22 23 23 28 28 29 29 23 32 43 23 23 31 31 32 32 13 13 38 1 1 1 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 8 8 8 8 8 8 8 10 10 10 10 10 10 10 10 10 10 10 10 14 14 14 14 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 21 21 21 21 21 21 21 21 21 21 27 27 27 27 30 30 30 30 30 30 30 30 30 36 36 36 5 5 5 5 5 5 5 5 5 19 19 19 31 31 31 30 30 30 30 30 30 33 33 33 33 16 16 16 16 24 24 24 24 36 36 36 36 24 24 24 24 42 42 42 42 39 39 39 39 19 19 19 24 24 24 24 24 24 27 27 27 27 27 27 39 39 39 39 39 39 30 30 30 30 30 30 45 45 45 45 33 33 33 33 31 31 31 42 42 42 42 42 42 45 45 45 19 31 47 19 31 47 19 31 47 18 18 18 30 30 30 23 31 43 23 31 43 34 35 34 35 7 17 7 17 20 25 20 25 37 38 37 38 20 26 20 26 43 44 43 44 40 41 40 41 5 5 5 25 26 25 26 25 26 29 34 29 34 29 34 7 41 7 41 7 41 31 32 43 31 32 43 37 48 37 48 12 35 12 35 5 5 5 15 44 15 44 15 44 46 48 46 65.0519 167.5852 -56.4388 -55.8518 46.6815 -177.3425 -175.2002 -72.6669 63.3091 -156.515 86.0834 -28.8139 -1.5375 135.6462 -136.2618 -63.3214 25.4667 153.058 -167.5983 -78.8103 48.781 -97.5959 153.3851 -2.9632 -111.9822 162.585 57.4578 -6.1836 -111.3108 49.5558 164.7792 -118.4772 -3.2538 -169.1413 -65.5714 -9.0386 94.5314 92.4816 -11.0025 -13.0662 -116.5504 -33.7831 -141.8174 62.2152 -45.8192 -35.7758 74.6137 60.6521 171.0415 -4.3165 -120.5231 99.961 -76.4976 31.6361 32.4478 140.5814 -175.6669 -67.5333 56.1887 -49.526 -53.7224 -159.4371 170.4331 64.7184 -31.6843 -145.3186 72.7041 -40.9303 -147.0873 99.2783 -34.7381 66.6608 -149.288 62.5929 163.9918 -51.957 -32.398 45.0576 -136.2152 -58.7596 74.1389 -172.5973 -33.5833 79.6804 58.6432 -49.6091 177.4931 54.2671 161.9258 -45.0281 62.6306 -172.3942 -64.7355 123.8281 17.7262 29.555 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 1 Grimme-D3(BJ) -0.0562765249 PCM SMD-Coulomb. Total charges None On-the-fly selection Water 78.355300 1.777849 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-2.0033,.9472,.9667;-2.0316,1.3243,2.3267;-2.9902,-.0291,.7577;-2.3282,2.0957,.203;-.723,.3908,.5902;2.8807,1.1324,-2.6464;.9353,.1096,3.8046;-2.9269,-2.1813,-1.466;-3.2198,-1.57,-.7812;2.1244,2.1244,1.7358;1.6079,1.7404,2.476;-2.6033,-2.9697,-.9709;1.5259,2.7758,1.3217;3.2741,.273,-2.4648;2.6337,-.3699,-2.8437;.6567,1.0515,3.8138;-.2265,1.0556,3.4292;1.1472,-1.7266,1.0112;.3607,-1.1591,.9331;1.887,-1.1389,.6911;-1.3821,1.8409,-2.7716;-1.8915,2.1141,-2.0005;-1.2289,.885,-2.6178;3.0357,-.0337,.285;3.0767,.1261,-.6802;2.7041,.7909,.7002;.6134,-3.7535,-.7017;.8436,-3.0269,-.0787;.426,-3.2997,-1.529;-.7351,-.7407,-2.0509;-.5357,-.4142,-1.156;-1.5232,-1.325,-1.9185;-1.9659,-4.321,-.1013;-1.0085,-4.1687,-.2763;-2.1892,-5.0876,-.6383;.4261,3.9658,.4589;.6339,3.5673,-.4132;-.4604,3.6458,.6525;1.5269,-1.5463,3.706;1.4012,-1.6808,2.7409;2.4785,-1.4454,3.808;1.4634,-1.4849,-3.4895;.6639,-1.2832,-2.9582;1.7573,-2.3456,-3.1768;1.0688,2.5757,-1.8103;.2014,2.3501,-2.2182;.0015,1.0102,.7346;1.2832,1.7961,-1.2862; 0.000000 1.411548 0.000000 1.403918 2.283123 0.000000 1.417038 2.278856 2.293715 0.000000 1.445923 2.366288 2.311895 2.373540 0.000000 6.078024 6.992745 6.885093 6.014956 4.900181 0.000000 4.170239 3.530216 4.971220 5.250472 3.627883 6.815133 0.000000 4.069268 5.241719 3.095260 4.630025 3.962451 6.789849 6.924210 0.000000 3.297215 4.410016 2.189811 3.898881 3.458265 6.928001 6.412190 0.963509 0.000000 4.360641 4.273302 5.635049 4.709169 3.524960 4.556332 3.122987 7.369301 6.967382 0.000000 3.993490 3.666229 5.217923 4.559172 3.287959 5.313043 2.208426 7.175220 6.698876 0.980813 0.000000 4.410971 5.444236 3.432880 5.206952 4.155167 7.050378 6.693992 0.985593 1.541166 7.458352 7.197235 0.000000 3.990689 3.971492 5.346209 4.070483 3.358757 4.503575 3.690856 7.223072 6.769841 0.976725 1.552792 7.437591 0.000000 6.330950 7.225886 7.051057 6.467255 5.032224 0.962451 6.693411 6.743429 6.957109 4.732307 5.416690 6.876776 4.863923 0.000000 6.144624 7.167172 6.686925 6.323183 4.861867 1.535195 6.878583 6.008311 6.321176 5.239612 5.814211 6.139387 5.336088 0.983391 0.000000 3.897746 3.084292 4.879306 4.799843 3.568140 6.832772 0.982238 7.153280 6.558477 2.761011 1.780227 7.049156 3.152709 6.846693 7.088830 0.000000 3.038498 2.132120 3.993945 3.988434 2.957765 6.824489 1.544596 6.460077 5.794921 3.088146 2.177800 6.419723 3.236043 6.899701 7.040081 0.963358 0.000000 4.132455 4.598201 4.479272 5.228995 2.856260 4.955513 3.349614 4.789721 4.723096 4.038647 3.791884 4.420376 4.529054 4.539248 4.348674 3.976558 3.933793 0.000000 3.166480 3.719249 3.540694 4.284607 1.922044 4.941061 3.191476 4.196315 3.990958 3.812687 3.513315 3.960882 4.122243 4.699398 4.478144 3.643184 3.388284 0.972971 0.000000 4.422972 4.908982 5.002352 5.335699 3.026916 4.157542 3.486906 5.377132 5.332252 3.434703 3.399162 5.126068 3.981644 3.725198 3.693775 4.007828 4.096369 0.997614 1.545489 0.000000 3.893511 5.165342 4.305671 3.131786 3.720031 4.323042 7.184283 4.502105 4.355748 5.717734 6.040444 5.279685 5.107431 4.922636 4.584674 6.938802 6.356222 5.782181 5.075627 5.617495 0.000000 3.190392 4.400897 3.661756 2.246438 3.323677 4.914668 6.760778 4.450648 4.101649 5.485191 5.694218 5.235593 4.811833 5.503444 5.230496 6.436498 5.777036 5.749326 4.938854 5.665999 0.963648 0.000000 3.667726 5.028401 3.915567 3.260522 3.285007 4.117124 6.821455 3.689454 3.655599 5.633352 5.892843 4.411303 5.165667 4.546985 4.067632 6.704355 6.131863 5.063189 4.394783 4.975329 0.980200 1.526621 0.000000 5.178633 5.629348 6.044395 5.771703 3.794811 3.158609 4.101180 6.574982 6.528970 2.755515 3.160129 6.480330 3.353742 2.777065 3.172296 4.391980 4.659891 2.638141 2.973536 1.644939 5.689722 5.840610 5.239897 0.000000 5.403040 6.047411 6.236897 5.819990 4.015123 2.217388 4.969841 6.479563 6.521675 3.276781 3.837283 6.475354 3.665162 1.801436 2.263416 5.187353 5.353729 3.164906 3.410438 2.212733 5.214829 5.511545 4.782044 0.979211 0.000000 4.717536 5.035512 5.753344 5.222472 3.452086 3.368642 3.637282 6.725669 6.546805 1.785182 2.292713 6.715843 2.390475 3.257351 3.729882 3.735504 4.013223 2.976338 3.057474 2.095668 5.463760 5.492156 5.146501 0.980964 1.576809 0.000000 5.632691 6.476949 5.383889 6.609447 4.541989 5.726630 5.944230 3.948343 4.412119 6.540203 6.424137 3.321663 6.896304 5.138148 4.485384 6.593852 6.395065 2.706836 3.076837 3.224580 6.289901 6.510693 5.346101 4.547278 4.595622 5.194962 0.000000 4.999187 5.743351 4.938081 6.031733 3.818692 5.295529 4.992629 4.105684 4.373489 5.609736 5.462420 3.560949 6.008235 4.742380 4.231973 5.640890 5.487947 1.723579 2.178426 2.290369 5.991726 6.132202 5.103480 3.727821 3.910262 4.317830 0.984387 0.000000 5.492448 6.502919 5.253239 6.300546 4.408066 5.188206 6.350598 3.535141 4.104035 6.554738 6.545187 3.097916 6.800646 4.663854 3.896944 6.894288 6.631607 3.073604 3.263153 3.425228 5.589197 5.907826 4.629942 4.557123 4.413920 5.185731 0.961958 1.533654 0.000000 3.682850 5.010808 3.671510 3.957672 2.873275 4.115441 6.148206 2.687300 2.910905 5.542991 5.669052 3.102403 5.371477 4.156034 3.480656 6.288368 5.789362 3.727146 3.206281 3.814806 2.757209 3.080444 1.791074 4.491641 4.142433 4.662877 3.565925 3.407206 2.858245 0.000000 2.917748 4.170015 3.136117 3.370399 1.931887 4.035412 5.200569 2.989478 2.946320 4.677920 4.735862 3.292409 4.534912 4.086504 3.591016 5.316831 4.824913 3.041613 2.392257 3.131541 2.900264 2.990514 2.074877 3.869834 3.683384 3.923489 3.560595 3.144793 3.064417 0.973260 0.000000 3.703802 5.029819 3.315648 4.104912 3.142912 5.095349 6.391920 1.705429 2.057135 6.209468 6.205813 2.183917 6.050889 5.085864 4.364398 6.577150 5.995548 3.984389 3.421742 4.298160 3.281816 3.459706 2.336591 5.225504 4.979740 5.404128 3.455864 3.447217 2.801937 0.989970 1.544750 0.000000 5.375532 6.145687 4.495239 6.434165 4.921791 7.726960 6.580580 2.713676 3.098774 7.851681 7.493694 1.728697 8.036372 7.358545 6.654927 7.146310 6.663177 4.202338 4.059629 5.059494 6.740876 6.709879 5.829055 6.598913 6.748299 6.970116 2.708331 3.093306 2.966901 4.258446 4.292002 3.531861 0.000000 5.357966 6.164106 4.704533 6.419887 4.649889 6.988854 6.223894 3.007554 3.449352 7.312118 7.024146 2.112675 7.563332 6.546626 5.855563 6.837577 6.452601 3.502613 3.520654 4.301092 6.517711 6.574622 5.574109 5.811051 5.941138 6.271705 1.727321 2.184716 2.093316 3.869778 3.885102 3.323888 0.985138 0.000000 6.247404 7.066058 5.308360 7.233805 5.802752 8.271902 7.517522 3.110635 3.668279 8.732502 8.410622 2.183524 8.915036 7.868907 7.097951 8.099901 7.624666 5.014791 4.940057 5.828783 7.294265 7.335450 6.364961 7.327569 7.410402 7.764811 3.104531 3.709099 3.290783 4.796443 4.984323 4.029873 0.962219 1.539295 0.000000 3.907908 4.062770 5.264989 3.338984 3.757440 4.867860 5.130667 7.261872 6.743542 2.811712 3.227682 7.702104 1.835833 5.504160 5.880414 4.449977 4.209301 5.764478 5.147267 5.314762 4.268553 3.853356 4.657903 4.778737 4.802737 3.915085 7.808292 7.025794 7.532572 5.458770 4.766214 6.119171 8.643298 8.292705 9.487255 0.000000 3.965362 4.432004 5.238318 3.364448 3.596983 3.995501 5.462285 6.843588 6.432612 2.986948 3.554378 7.315935 2.105251 4.693832 5.040675 4.919106 4.670459 5.506217 4.922051 4.993846 3.550610 3.317971 3.940192 4.384425 4.228481 3.637856 7.326507 6.606057 6.960211 4.807807 4.215658 5.554626 8.311546 7.909632 9.106512 0.981064 0.000000 3.124350 3.265052 4.462756 2.468489 3.266170 5.325670 4.938485 6.672838 6.072412 3.188957 3.351653 7.140860 2.269433 5.919428 6.158163 4.239393 3.804469 5.619265 4.882664 5.329678 3.978872 3.381187 4.348235 5.088837 5.164786 4.262269 7.598419 6.838154 7.333817 5.159916 4.445152 5.696342 8.142756 7.888572 8.995960 0.962166 1.529511 0.000000 5.116945 4.775492 5.603400 6.355864 4.303715 7.025703 1.761126 6.854827 6.531940 4.208589 3.510225 6.399795 4.936119 6.666373 6.745917 2.741708 3.149716 2.727357 3.032910 3.063498 7.867218 7.592552 7.314026 4.033282 4.943421 3.985285 5.013349 4.121018 5.629472 6.237552 5.401342 6.402073 5.864660 5.400385 6.724777 6.491415 6.626734 6.342751 0.000000 4.652397 4.581068 5.093667 5.883192 3.664571 6.255105 2.134022 6.056474 5.811278 4.001619 3.437695 5.610200 4.678839 5.867248 5.867369 3.028295 3.257461 1.748875 2.150087 2.175195 7.108885 6.908229 6.497404 3.378785 4.216235 3.459957 4.094889 3.173812 4.669443 5.330020 4.532306 5.512598 5.136746 4.593472 5.992980 6.167903 6.170904 6.016624 0.982451 0.000000 5.821032 5.496062 6.420063 6.974312 4.896483 6.961814 2.190775 7.587832 7.317588 4.142858 3.561179 7.140435 4.990837 6.552428 6.739954 3.090858 3.703490 3.110269 3.582197 3.187334 8.306327 8.093560 7.776038 3.836067 4.792936 3.835433 5.398452 4.503386 6.011195 6.719455 5.898341 6.987219 6.580622 6.021407 7.404194 6.686641 6.808019 6.671983 0.962358 1.534519 0.000000 6.147449 7.343995 6.323962 6.389966 4.994210 3.093473 7.484990 4.884095 5.410539 6.384975 6.783080 5.008545 6.426925 2.723755 1.740624 7.773138 7.561622 4.518241 4.569595 4.216203 4.435406 5.140481 3.691182 4.338718 3.618002 4.926666 3.693349 3.794137 2.865891 2.730727 3.253916 3.378348 5.593120 4.861797 5.869434 6.809968 5.972972 6.868834 7.195982 6.233791 7.367883 0.000000 5.243439 6.480311 5.360311 5.510243 4.161319 3.293366 6.910078 3.990886 4.461412 5.981524 6.289954 4.179459 5.961240 3.078696 2.174242 7.163133 6.860142 4.023226 3.905060 3.851525 3.739028 4.357527 2.898186 4.207694 3.605111 4.674202 3.346170 3.371143 2.483105 1.753480 2.332826 2.421978 4.930086 4.279641 5.291109 6.267746 5.477692 6.212544 6.724956 5.760356 7.007218 0.980911 0.000000 6.492663 7.623206 6.586814 6.916714 5.275464 3.693218 7.446115 4.989617 5.577830 6.652100 6.976567 4.926500 6.820563 3.108834 2.186882 7.849883 7.690511 4.277276 4.499990 4.053876 5.248524 5.881017 4.434780 4.354689 3.752780 5.075988 3.068730 3.301149 2.323385 3.171125 3.615581 3.658823 5.217587 4.402958 5.434862 7.404391 6.622902 7.448449 6.932898 5.965633 7.079472 0.961779 1.540231 0.000000 4.449937 5.319123 5.464039 3.977879 3.707682 2.462756 6.134111 6.222022 6.052918 3.727390 4.400114 6.703742 3.171571 3.254878 3.491935 5.841593 5.607274 5.145643 4.687969 4.552513 2.733259 3.002032 2.964772 3.881767 3.362921 3.487536 6.441685 5.868479 5.917198 3.782897 3.455689 4.684619 7.726232 7.221870 8.409214 2.737652 1.767595 3.090151 6.901471 6.240404 7.051479 4.411781 4.046296 5.153754 0.000000 4.119779 5.166628 4.970249 3.510810 3.546885 2.973990 6.467791 5.557548 5.397859 4.402587 4.938101 6.141862 3.803453 3.717063 3.702147 6.186948 5.809617 5.286140 4.719193 4.845461 1.753043 2.117363 2.086195 4.470031 3.946938 4.148678 6.302652 5.822587 5.696174 3.233901 3.051681 4.070717 7.326811 6.908668 7.970650 3.134854 2.219561 3.218286 7.213451 6.502333 7.477059 4.232759 3.736625 5.038865 0.984624 0.000000 2.019230 2.601332 3.167243 2.624659 0.964072 4.442464 3.332881 4.858416 4.396827 2.598157 2.479129 5.053051 2.405418 4.635633 4.651604 3.148408 2.704627 2.979826 2.207824 2.859317 3.859739 3.504670 3.573236 3.240026 3.498527 2.711657 5.012973 4.203450 4.886663 3.371521 2.427285 3.849277 5.743806 5.372458 6.623256 2.998648 2.873354 2.677025 4.206094 3.636742 4.648823 5.119115 4.397153 5.444614 3.172786 3.248706 0.000000 4.073992 4.925759 5.076526 3.917867 3.085531 2.200604 5.374195 5.794576 5.644671 3.154094 3.776606 6.157657 2.796454 2.769962 2.990229 5.192036 5.006282 4.207915 3.809185 3.590122 3.051526 3.269471 2.985582 2.981305 2.524425 2.641126 5.620355 4.991310 5.173133 3.330685 2.865390 4.244624 7.027055 6.469205 7.737114 2.913332 2.078663 3.196867 6.012728 5.321742 6.155332 3.956244 3.558232 4.577491 0.963556 1.531523 2.518720 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8329,-1.4195,-1.7526;-1.798,-2.4107,-1.4725;.3145,-2.0497,-2.2599;-1.372,-.5764,-2.7559;-.4618,-.6808,-.5663;-.3372,3.928,1.0937;-2.1264,-2.5799,2.0383;3.1939,-.9295,-2.0745;2.4112,-1.4234,-2.3423;-3.1109,.3388,1.5237;-3.0249,-.6377,1.4927;3.5558,-1.436,-1.3104;-3.3346,.6017,.61;.2196,3.6858,1.8404;1.0885,3.4709,1.4331;-2.8699,-2.4097,1.4195;-2.4948,-2.5227,.5394;.7245,-.8214,2.0281;.4528,-.9495,1.1027;.2151,-.0101,2.3067;.0596,2.2074,-2.8522;-.4294,1.427,-3.136;.7647,1.8398,-2.2791;-.783,1.2396,2.6909;-.466,2.095,2.3348;-1.6095,1.0162,2.2121;3.3845,-.3619,1.8282;2.4181,-.5151,1.9359;3.436,.3688,1.2047;1.7664,1.0797,-1.0036;1.0167,.5586,-.6666;2.3734,.3985,-1.3878;4.1479,-2.2813,.0765;3.8913,-1.6269,.7668;5.1056,-2.2077,.0202;-3.6908,1.1649,-1.1006;-2.9806,1.8402,-1.0552;-3.3161,.4741,-1.6557;-.802,-2.7633,3.1846;-.1982,-2.0861,2.8078;-1.1462,-2.3534,3.9844;2.6031,3.0603,.6799;2.3535,2.3106,.0986;3.1203,2.6634,1.387;-1.565,2.8542,-.7515;-.987,2.6915,-1.5318;-1.217,-.243,-.1571;-1.2004,2.2743,-.0738; 0.2039159 0.1804237 0.1725995 -24.63585 -24.63465 -24.63428 -19.12311 -19.12291 -19.12157 -19.12129 -19.12080 -19.12074 -19.11954 -19.11910 -19.11870 -19.11826 -19.11740 -19.11676 -19.11052 -19.10997 -19.10823 -6.84159 -1.19287 -1.14828 -1.14546 -1.02788 -1.02381 -1.02193 -1.01930 -1.01581 -1.01340 -1.00956 -1.00773 -1.00570 -1.00035 -0.99898 -0.99746 -0.99342 -0.99036 -0.98525 -0.56814 -0.53657 -0.53519 -0.53357 -0.53215 -0.53156 -0.52999 -0.52956 -0.52926 -0.52805 -0.52785 -0.52612 -0.52294 -0.52144 -0.51707 -0.51615 -0.49512 -0.49068 -0.43680 -0.42708 -0.42391 -0.42140 -0.41931 -0.41556 -0.41232 -0.40985 -0.40834 -0.40489 -0.40355 -0.39891 -0.39433 -0.38991 -0.38754 -0.38338 -0.38016 -0.37608 -0.37529 -0.36222 -0.34798 -0.32514 -0.32393 -0.32378 -0.32319 -0.32278 -0.32068 -0.31982 -0.31880 -0.31809 -0.31770 -0.31693 -0.31566 -0.31436 -0.30900 -0.30815 -0.00897 0.01636 0.02116 0.02386 0.04583 0.04880 0.05493 0.06771 0.07405 0.07753 0.08836 0.09441 0.09835 0.10203 0.11008 0.11220 0.11514 0.12368 0.12835 0.13745 0.13861 0.14298 0.14361 0.14607 0.14847 0.15342 0.15439 0.15935 0.16164 0.16836 0.17710 0.17958 0.18058 0.18336 0.18482 0.19039 0.19269 0.19405 0.19991 0.20126 0.20497 0.20671 0.21406 0.21562 0.21778 0.22257 0.22689 0.22935 0.23647 0.23771 0.24249 0.24456 0.24783 0.24937 0.25418 0.25632 0.25909 0.26586 0.27089 0.27331 0.27644 0.27861 0.28111 0.28428 0.28487 0.28956 0.29358 0.29467 0.29763 0.29992 0.30337 0.30732 0.31173 0.31372 0.31447 0.31463 0.32309 0.32557 0.33296 0.33540 0.34298 0.34486 0.35809 0.36287 0.37215 0.37701 0.38214 0.39033 0.39987 0.40324 0.41593 0.42011 0.43383 0.44116 0.45716 0.46253 0.46663 0.48542 0.48690 0.49010 0.50124 0.51122 0.52029 0.52497 0.52563 0.53041 0.53628 0.54111 0.54828 0.55846 0.56100 0.56414 0.56470 0.57034 0.57480 0.58032 0.58923 0.59172 0.59810 0.60840 0.61640 0.61871 0.62351 0.63165 0.63304 0.63808 0.64527 0.65169 0.65987 0.66287 0.67242 0.67809 0.68013 0.69024 0.69404 0.70129 0.71246 0.71431 0.73599 0.75576 0.76047 0.82470 0.93078 0.94942 0.96241 0.97133 0.98200 0.98349 0.98598 0.99065 0.99689 0.99845 1.00333 1.00736 1.01463 1.01808 1.02270 1.02698 1.03013 1.03270 1.03695 1.04992 1.05417 1.05839 1.06163 1.06466 1.08640 1.08796 1.09098 1.09537 1.09800 1.10814 1.10987 1.11874 1.12295 1.12752 1.13278 1.14067 1.14638 1.15208 1.17085 1.17398 1.18082 1.18664 1.20043 1.20897 1.21305 1.23009 1.24242 1.24874 1.25925 1.26251 1.27656 1.28062 1.29715 1.30617 1.31033 1.31333 1.31619 1.32240 1.32505 1.33521 1.34066 1.34743 1.34960 1.35511 1.35839 1.36711 1.37348 1.37752 1.38245 1.38775 1.39687 1.39981 1.41067 1.41369 1.41892 1.42494 1.43212 1.43542 1.43957 1.44227 1.44511 1.44974 1.45981 1.46389 1.46836 1.47476 1.48310 1.49190 1.50317 1.50976 1.51932 1.52313 1.53007 1.53689 1.54021 1.54660 1.55138 1.55967 1.56929 1.58058 1.59803 1.60230 1.60992 1.61541 1.63125 1.64128 1.64983 1.65149 1.66121 1.66828 1.68707 1.69218 1.69413 1.70625 1.71034 1.71238 1.73513 1.74477 1.75330 1.75476 1.76575 1.77340 1.77913 1.78420 1.80368 1.81808 1.82444 1.83507 1.84610 1.85274 1.86099 1.92433 2.01904 2.02757 2.03967 2.04894 2.05589 2.07292 2.09548 2.10003 2.11682 2.13290 2.13608 2.14746 2.16975 2.21129 2.26034 2.29025 2.29674 2.30006 2.32181 2.32853 2.33671 2.34757 2.35891 2.36654 2.39189 2.39466 2.40696 2.42412 2.43256 2.45036 2.46155 2.47450 2.49087 2.51549 2.59102 2.63768 2.64711 2.65485 2.66111 2.68599 2.69790 2.70425 2.70810 2.71710 2.72227 2.73504 2.74175 2.74601 2.76235 2.77017 2.77474 2.78686 2.79296 2.80506 2.81091 2.82712 2.83560 2.84636 2.84864 2.85658 2.87997 2.89002 2.89955 2.93269 3.06949 3.07216 3.07582 3.08383 3.09096 3.09238 3.09641 3.10010 3.10993 3.11235 3.11746 3.12115 3.12895 3.12965 3.14031 3.14150 3.14970 3.15058 3.15201 3.15829 3.15995 3.16550 3.17257 3.17505 3.17838 3.18227 3.19194 3.20741 3.21309 3.22681 3.25912 3.29997 3.31519 3.31816 3.32926 3.33609 3.33971 3.34114 3.34738 3.35193 3.35846 3.36407 3.37691 3.38854 3.39754 3.56917 3.68662 3.70055 3.70723 3.71256 3.71772 3.72368 3.73852 3.74405 3.75440 3.75945 3.77305 3.77471 3.78133 3.78877 3.80310 3.81495 3.82180 3.83186 3.84800 3.85484 3.90401 3.90869 3.91579 3.91887 3.92555 3.94023 3.94441 3.94611 3.94747 3.95694 3.95926 3.96377 3.96797 3.97379 3.97720 3.98341 3.99444 4.01148 4.12061 4.24266 4.26578 4.42730 4.66061 4.67775 5.01112 5.01729 5.02521 5.02701 5.02923 5.03932 5.04572 5.05043 5.05859 5.06191 5.07314 5.09319 5.18895 5.21021 5.27397 5.36196 5.38303 5.39301 5.40320 5.41126 5.42420 5.42984 5.43705 5.44713 5.45177 5.45687 5.50060 5.51964 5.54261 5.55028 5.61600 5.67120 5.67334 5.68160 5.69022 5.69185 5.69563 5.70058 5.70404 5.71367 5.71980 5.72662 5.77049 5.80402 5.81564 6.34609 6.35727 6.38796 6.42399 6.43561 6.45854 6.47778 6.60691 6.63044 14.61659 49.88757 49.89645 49.90468 49.91390 49.91883 49.92534 49.93081 49.93593 49.94713 49.95055 49.95960 49.96642 49.97711 49.98825 49.99412 66.85257 66.86449 66.87227 1-A. 7.5659 1.8483 1.9404 8.0264 -163.2689 -187.5111 -169.6937 -1.6532 6.0580 -1.6977 10.2223 -14.0199 3.7975 -1.6532 6.0580 -1.6977 222.3649 -30.8981 21.1809 13.3887 -12.1307 -3.6385 -13.5733 -28.6915 -22.6116 12.9164 -4053.6019 -3832.4497 -2920.8943 -63.0806 128.2298 -124.3455 57.9284 -1.9834 -78.6622 -1388.0895 -1331.6483 -1275.1181 98.4034 10.7853 50.7052 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; 0.000000 1.429564 0.000000 1.418481 2.306729 0.000000 1.448307 2.301244 2.312318 0.000000 1.429197 2.383341 2.331118 2.383573 0.000000 5.520793 6.501634 6.342232 5.424535 4.397805 0.000000 3.984773 3.260297 4.882564 5.030790 3.569580 6.589872 0.000000 3.906074 5.033336 2.844212 4.558264 3.895258 6.529155 6.802997 0.000000 3.042621 4.116965 1.886320 3.753130 3.264165 6.448481 6.128335 0.970396 0.000000 3.603448 3.661322 4.939846 3.868640 2.847990 4.054987 3.109571 6.703725 6.107579 0.000000 3.521692 3.224324 4.830470 4.012968 2.945565 4.963776 2.223884 6.813198 6.146305 0.984428 0.000000 4.294644 5.270630 3.248670 5.177473 4.144068 6.883449 6.655398 0.982740 1.548031 6.916301 6.943130 0.000000 3.518521 3.581841 4.919305 3.426485 3.072751 4.226956 3.740103 6.866508 6.216419 0.978002 1.568511 7.201164 0.000000 6.086233 7.044453 6.834907 6.167957 4.839005 0.977250 6.789814 6.775998 6.787469 4.518637 5.364434 7.014959 4.860422 0.000000 5.958204 7.028103 6.517880 6.131965 4.703822 1.552387 6.943121 6.097338 6.221896 4.950382 5.726560 6.307620 5.321612 0.981655 0.000000 3.736774 2.845655 4.799072 4.572482 3.549735 6.584262 0.983250 7.016263 6.262173 2.764243 1.792562 6.996276 3.182373 6.912385 7.140948 0.000000 2.909438 1.891518 3.925950 3.794167 3.003123 6.556440 1.548281 6.308081 5.496281 2.931950 2.090192 6.347087 3.178721 6.960801 7.101694 0.970888 0.000000 4.020778 4.486114 4.415534 5.167685 2.785432 4.799240 3.486949 4.759003 4.540936 3.859965 3.818538 4.451971 4.647614 4.673201 4.408804 4.129163 4.099043 0.000000 3.048222 3.610573 3.478644 4.213329 1.843102 4.655423 3.272686 4.146531 3.790609 3.449443 3.409571 3.980874 4.102320 4.725301 4.469842 3.742963 3.515637 0.979189 0.000000 4.326590 4.832780 4.941894 5.282148 2.956943 4.045859 3.655834 5.352984 5.147082 3.380116 3.520509 5.162172 4.219558 3.865764 3.735570 4.205370 4.307095 0.987092 1.536966 0.000000 3.651707 4.951712 4.023279 2.900605 3.525636 3.873940 6.923982 4.454615 4.184290 4.891821 5.519259 5.255952 4.547019 4.661351 4.469533 6.668341 6.102938 5.661037 4.909898 5.517914 0.000000 2.865144 4.101116 3.327457 1.953954 3.032213 4.368728 6.340294 4.335936 3.865491 4.503033 5.009757 5.127128 4.088325 5.171475 5.040288 6.012325 5.374794 5.497237 4.648440 5.440573 0.970584 0.000000 3.518616 4.911601 3.712944 3.157083 3.169260 3.690141 6.685493 3.689708 3.543361 4.909473 5.496029 4.437434 4.754500 4.327320 3.960229 6.567178 6.012995 4.997308 4.295229 4.920048 0.980650 1.529774 0.000000 5.080115 5.572997 6.001276 5.658468 3.718248 3.016868 4.287241 6.620126 6.390300 2.832922 3.327517 6.608782 3.647417 2.807280 3.123441 4.591812 4.877976 2.754506 3.034707 1.779296 5.546358 5.584911 5.154935 0.000000 5.325888 6.017983 6.197084 5.730823 3.959787 2.134599 5.147502 6.562782 6.421231 3.288477 3.966482 6.637877 3.930567 1.826911 2.210004 5.377752 5.565701 3.289757 3.484162 2.347462 5.120538 5.319905 4.730457 0.982118 0.000000 4.483705 4.879238 5.562623 4.964272 3.233858 3.069092 3.768168 6.573985 6.214550 1.865377 2.444657 6.652244 2.680638 3.163275 3.574144 3.895800 4.164874 2.975061 2.978940 2.134836 5.152174 5.067900 4.896685 0.976206 1.553007 0.000000 5.531780 6.363573 5.271189 6.588906 4.502157 5.766195 6.089308 3.960713 4.320720 6.330993 6.442081 3.371561 6.986348 5.439018 4.718360 6.739509 6.526488 2.744912 3.108936 3.256944 6.276581 6.381752 5.350682 4.730252 4.801700 5.233883 0.000000 4.883056 5.626777 4.826921 5.984956 3.757065 5.253880 5.148576 4.078006 4.223447 5.409262 5.487228 3.585536 6.105169 4.978849 4.389073 5.798200 5.635629 1.759994 2.201260 2.313378 5.916887 5.938218 5.056738 3.894086 4.089108 4.343930 0.985997 0.000000 5.456542 6.464332 5.188873 6.345849 4.424818 5.243930 6.522784 3.618972 4.088196 6.331910 6.573140 3.214768 6.901146 4.946447 4.131727 7.072544 6.804304 3.141248 3.334199 3.483205 5.649056 5.870718 4.694195 4.737318 4.619282 5.225504 0.965579 1.542556 0.000000 3.594745 4.937364 3.555033 3.959879 2.790774 3.772414 6.095579 2.774756 2.872558 4.935099 5.386419 3.200945 5.135014 4.034642 3.402183 6.250168 5.775721 3.637212 3.108255 3.717258 2.790551 3.055570 1.837451 4.419045 4.099414 4.435403 3.520351 3.309081 2.866735 0.000000 2.780637 4.058310 2.991360 3.310825 1.823319 3.685293 5.144233 3.011722 2.811082 4.059320 4.443951 3.361831 4.293082 4.015924 3.565390 5.271657 4.802242 2.997914 2.319123 3.091640 2.828806 2.825111 2.049002 3.850092 3.703006 3.729217 3.589386 3.124501 3.162585 0.981391 0.000000 3.631479 4.959244 3.205130 4.122997 3.089616 4.755069 6.347373 1.814295 2.075331 5.587012 5.912842 2.285111 5.782217 4.988447 4.307013 6.539887 5.974438 3.910055 3.346302 4.214884 3.275022 3.413356 2.339891 5.184019 4.961641 5.199295 3.385947 3.339835 2.777123 0.983028 1.541663 0.000000 5.360303 6.063823 4.461001 6.498920 4.994703 7.683795 6.673198 2.773866 3.164994 7.516781 7.415938 1.793574 7.993480 7.620720 6.899758 7.232556 6.731395 4.296415 4.167078 5.147794 6.775491 6.646523 5.907444 6.814158 6.987838 7.019102 2.752814 3.153798 3.058951 4.360437 4.411259 3.627099 0.000000 5.322842 6.083305 4.645182 6.465939 4.701486 6.987187 6.360249 3.038639 3.442407 7.040572 7.002719 2.159423 7.588442 6.838763 6.112021 6.969510 6.566420 3.605224 3.629624 4.396252 6.543063 6.493888 5.634504 6.040856 6.192504 6.341426 1.772212 2.252193 2.173800 3.931444 3.989410 3.362668 0.985249 0.000000 6.256352 6.997234 5.292314 7.333990 5.897760 8.317394 7.615029 3.257973 3.823408 8.425127 8.354817 2.321302 8.901436 8.203695 7.418226 8.191615 7.695963 5.121831 5.060905 5.935535 7.408141 7.351446 6.513882 7.573683 7.689579 7.842773 3.180924 3.791189 3.416614 4.961989 5.154745 4.188644 0.965080 1.549492 0.000000 3.739926 3.979402 5.031966 2.891397 3.824700 4.752648 5.308966 7.065389 6.381187 2.846672 3.337031 7.621881 1.897654 5.612961 6.033145 4.610766 4.317423 6.073110 5.355968 5.731199 3.884647 3.348166 4.458581 5.208729 5.229477 4.309647 8.062126 7.291232 7.809790 5.476497 4.794118 6.071065 8.755042 8.475308 9.624641 0.000000 4.021697 4.536843 5.245714 3.170518 3.858472 3.937268 5.732565 6.931718 6.353954 2.954706 3.669573 7.516061 2.136374 4.843075 5.286429 5.151128 4.897367 5.970721 5.306204 5.533915 3.355401 3.043658 3.948762 4.860185 4.711738 4.046345 7.785929 7.060976 7.444161 5.048717 4.476498 5.743943 8.682908 8.334316 9.512364 0.971425 0.000000 2.904960 3.245778 4.134367 1.936712 3.231726 4.932921 5.100433 6.261388 5.534298 3.028719 3.389192 6.843586 2.204798 5.781619 6.051737 4.436970 3.955024 5.744706 4.929156 5.547398 3.390914 2.681072 3.928001 5.324811 5.370098 4.462371 7.599822 6.868996 7.349038 4.946434 4.253861 5.425397 8.042655 7.842453 8.907461 0.970973 1.526668 0.000000 4.889465 4.478958 5.464442 6.142117 4.171307 6.868972 1.796069 6.715280 6.233445 4.219631 3.569807 6.331658 5.043208 6.827924 6.832473 2.778250 3.163556 2.769772 3.022845 3.131236 7.620550 7.181488 7.166741 4.194547 5.101301 4.079946 5.101686 4.217961 5.736159 6.130517 5.302618 6.304358 5.897940 5.476015 6.763076 6.714921 6.963207 6.471448 0.000000 4.478585 4.360506 5.008376 5.735530 3.560816 6.092641 2.214570 5.984572 5.581424 3.929551 3.472190 5.608285 4.784549 6.014893 5.944388 3.111579 3.341625 1.790814 2.155815 2.217127 6.915614 6.560635 6.391713 3.508751 4.349639 3.505429 4.190705 3.275551 4.785148 5.247416 4.465782 5.447824 5.224984 4.709600 6.087928 6.424576 6.555041 6.151666 0.984014 0.000000 5.692065 5.295103 6.352286 6.871250 4.865601 7.014481 2.307520 7.519954 7.084243 4.454527 3.852819 7.125638 5.342162 6.886312 6.968621 3.233763 3.819946 3.209799 3.645830 3.351176 8.206049 7.822823 7.761582 4.135907 5.090904 4.117299 5.523655 4.643331 6.172171 6.713662 5.910582 6.973687 6.618092 6.109591 7.443388 7.128255 7.336304 7.001452 0.965105 1.547858 0.000000 6.026127 7.225334 6.189028 6.381965 4.854439 3.178017 7.412498 5.017279 5.391513 5.985520 6.607624 5.131085 6.391893 2.786483 1.807439 7.734238 7.553652 4.318254 4.394457 3.994062 4.647339 5.244139 3.854952 4.162985 3.488784 4.680360 3.572290 3.598842 2.778465 2.729059 3.272389 3.361209 5.647926 4.871250 6.006623 7.041604 6.377412 6.825970 7.042899 6.072834 7.310735 0.000000 5.122689 6.362812 5.219915 5.507144 4.024149 3.218297 6.826818 4.104387 4.427407 5.503400 6.071188 4.280624 5.863920 3.080458 2.189529 7.111496 6.837985 3.824447 3.723738 3.640448 3.927724 4.440860 3.058612 4.058685 3.506383 4.421938 3.209967 3.162386 2.389823 1.751167 2.345138 2.398405 4.973192 4.275712 5.414206 6.445453 5.853113 6.125480 6.561571 5.598026 6.943026 0.985529 0.000000 6.300286 7.400225 6.437714 6.843306 5.049920 3.714804 7.239873 5.223247 5.616681 6.139898 6.672642 5.154638 6.673408 3.155638 2.253597 7.675260 7.563012 3.953113 4.229291 3.666349 5.416684 5.916762 4.586004 4.013709 3.475113 4.675308 2.978387 3.061735 2.318791 3.198040 3.610636 3.714261 5.356910 4.487541 5.689263 7.539703 6.938418 7.324530 6.648660 5.673694 6.856133 0.965088 1.551926 0.000000 4.441360 5.356861 5.442488 3.974330 3.688373 1.886646 6.087279 6.289522 5.974411 3.246455 4.175305 6.811599 3.000488 2.838933 3.248566 5.821769 5.648836 5.133201 4.659159 4.541853 2.781269 3.032786 3.021684 3.713787 3.203517 3.240726 6.511627 5.894911 6.034678 3.823599 3.495197 4.720689 7.884294 7.367782 8.619061 2.977519 2.106744 3.177446 6.828082 6.181601 7.123224 4.467432 4.117555 5.084824 0.000000 4.026076 5.112960 4.861404 3.437803 3.441908 2.394844 6.320551 5.580152 5.281621 3.732638 4.564529 6.195278 3.429091 3.316886 3.462323 6.055273 5.728227 5.202422 4.610715 4.766309 1.800584 2.155344 2.122057 4.275494 3.776059 3.835377 6.315389 5.782680 5.766441 3.248077 3.029566 4.074260 7.426680 6.993080 8.132150 3.097816 2.292450 3.027129 7.051312 6.366887 7.460403 4.318637 3.823413 5.026503 0.984490 0.000000 2.013418 2.604355 3.196502 2.644783 0.978846 3.994812 3.209061 4.841454 4.235104 1.873621 2.088793 5.082386 2.161525 4.470717 4.531608 3.080701 2.727501 2.907737 2.133873 2.796614 3.752562 3.291815 3.549796 3.138840 3.446816 2.474997 5.014924 4.177208 4.956544 3.363305 2.406661 3.857205 5.835584 5.453662 6.741511 3.226197 3.265195 2.840738 4.020884 3.481465 4.581854 5.037549 4.327465 5.231558 3.203953 3.203465 0.000000 3.855449 4.663828 4.952941 3.644679 2.963465 2.090843 5.134801 5.998854 5.615672 2.353857 3.269011 6.423117 2.274908 2.879662 3.271513 4.908343 4.778879 4.319015 3.847536 3.729923 3.105538 3.137062 3.178402 2.972819 2.664436 2.383862 5.983329 5.271569 5.628012 3.625406 3.084851 4.494554 7.363189 6.834428 8.151633 2.783031 2.136246 2.921432 5.872904 5.252420 6.169847 4.433714 4.010681 4.901993 0.967185 1.539481 2.349077 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8654,-1.4601,-1.4103;-1.614,-2.5947,-.9676;.2491,-1.9276,-2.1529;-1.7272,-.7394,-2.3245;-.4198,-.6318,-.3343;-.7576,3.6132,.7642;-1.6067,-2.7412,2.2894;2.8283,-.7742,-2.4795;1.9879,-1.2583,-2.4473;-2.605,.0529,1.359;-2.6424,-.9058,1.5792;3.403,-1.2231,-1.8207;-3.2258,.1851,.6149;-.1456,3.8413,1.4912;.751,3.6845,1.1236;-2.4309,-2.677,1.757;-2.1421,-2.7949,.8376;1.1457,-.6244,1.9696;.7308,-.7853,1.0973;.6354,.1463,2.3161;-.6945,1.9407,-2.7295;-1.0923,1.0559,-2.762;.1731,1.7816,-2.3011;-.5524,1.3845,2.787;-.3865,2.2589,2.3718;-1.3144,1.0156,2.3009;3.7256,.0258,1.2943;2.7959,-.1752,1.5541;3.6499,.7729,.6873;1.4851,1.2453,-1.1318;.8257,.6397,-.73;2.0927,.637,-1.6082;4.3971,-1.9404,-.5115;4.21,-1.2658,.1818;5.3386,-1.8512,-.7039;-3.9554,.6209,-1.0818;-3.5559,1.505,-1.0321;-3.3064,.1048,-1.5869;-.0816,-2.7591,3.2378;.3997,-1.992,2.8528;-.2643,-2.5091,4.1519;2.3872,3.2406,.4971;2.1349,2.465,-.0562;2.8486,2.872,1.2604;-1.9622,2.7184,-.3793;-1.5049,2.5106,-1.226;-1.1616,-.3244,.2256;-1.8335,1.9255,.1595; 0.2125080 0.1874234 0.1734444 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 600 600 600 600 600 MxSgAt= 48 MxSgA2= 48. NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 592 RedAO= T EigKep= 8.02D-05 NBF= 592 NBsUse= 592 1.00D-06 EigRej= -1.00D+00 NBFU= 592 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 604 602 603 604 604 MxSgAt= 48 MxSgA2= 48. 1 2.97663739e+00 7.27188065e-01 7.63408351e-01 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 5 9 9 9 8 1 1 8 1 8 1 1 1 8 1 8 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 1 0.007545765 -0.003244804 -0.003051673 0.002147443 0.003266144 0.011683550 -0.006825720 -0.007876907 -0.003575165 -0.000242205 0.007574076 -0.005986525 0.002640767 -0.003185083 -0.002341277 -0.001161807 0.004221445 -0.000852468 0.000307027 -0.001909015 0.000389487 -0.001077641 -0.001169353 -0.003112707 -0.001241880 0.003868926 0.003699106 0.002299825 -0.000981236 -0.001321470 -0.000646347 -0.000315395 0.001751483 -0.000257161 -0.001083081 0.000996848 -0.001136711 0.002174320 -0.000590425 0.002598241 -0.000826137 0.002034449 -0.001338952 -0.001239716 -0.001324513 0.001996908 0.002418108 0.001585184 -0.005692268 0.000150198 -0.002582240 0.000816340 -0.001846300 0.000356247 -0.003039215 0.002638893 -0.000587874 -0.001181075 -0.000986749 0.000572844 0.000387736 0.001632170 -0.003109398 -0.002912174 0.001360564 0.004139657 0.000399277 -0.003386804 0.000004533 0.002278270 -0.000956401 0.000561952 0.000801618 0.000446160 -0.002306367 -0.000592158 0.001941301 0.001339644 0.000609592 -0.003529043 0.000547429 0.000915621 0.002393219 0.001984620 -0.000010342 0.001887356 -0.004033902 0.001052461 -0.000586416 -0.002839794 -0.000551313 0.001700053 0.004385574 0.000923297 0.000561876 -0.000419247 -0.001480767 0.000650018 0.001564522 0.002135342 0.000137308 0.000189799 -0.001475347 -0.003206706 -0.000998425 0.002198617 0.002152161 0.001589193 0.000316193 -0.000879240 -0.002649657 -0.004879642 -0.001643821 0.001231053 -0.001466362 -0.000268744 0.002809691 -0.000682685 -0.000601314 -0.003384933 0.003261203 -0.000241368 0.001391866 0.001413248 0.000970120 -0.002191919 -0.003624549 0.000888012 0.002004039 0.001217197 -0.003669543 0.000291589 0.001658515 0.001451548 -0.001092877 -0.001009167 0.000119144 -0.000942851 0.000583049 0.001890791 0.000711658 0.002021934 -0.002860732 0.001479692 0.011683550 0.002587705 (Enter /usr/local/gaussian/gaussian16/g16/l716.exe) Closed 1 1 1 -1471.49363666347 -1471.49363814740 -0.000001483931 -1471.49363814882 -0.000000001410 -1471.49363816474 -0.000000015927 -1471.49363816529 -0.000000000546 -1471.49363816534 -0.000000000052 -1471.49363817 6 1.466649460484e+03 -7.677212902404e+03 2.651730135016e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 11324620800 LenX= 11323862024 LenY= 11323488092 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. (Enter /usr/local/gaussian/gaussian16/g16/l716.exe) PT123366.300S Wed Nov 6 03:04:24 2024 Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.128253 -0.479049 -0.463617 -0.475675 -0.948040 0.309166 0.418683 -0.756975 0.313182 -0.803340 0.396425 0.445994 0.382639 -0.751416 0.434507 -0.738698 0.316552 -0.838097 0.391379 0.470003 -0.689283 0.301606 0.390413 -0.830698 0.436207 0.386338 -0.679141 0.396924 0.291823 -0.851160 0.393712 0.459926 -0.773657 0.429780 0.321227 -0.711596 0.394395 0.310662 -0.724440 0.400375 0.303693 -0.731609 0.409033 0.313808 -0.702423 0.403981 0.302026 0.296201 -1.00000 -24.64590 -24.64474 -24.64198 -19.12476 -19.12381 -19.12195 -19.12145 -19.12124 -19.12092 -19.12072 -19.11964 -19.11944 -19.11907 -19.11568 -19.11514 -19.11267 -19.11122 -19.11056 -6.85377 -1.19700 -1.15522 -1.15205 -1.02637 -1.02121 -1.01977 -1.01521 -1.01326 -1.01162 -1.00963 -1.00793 -1.00529 -1.00068 -0.99843 -0.99466 -0.99385 -0.99130 -0.98674 -0.57672 -0.53933 -0.53903 -0.53431 -0.53240 -0.53180 -0.53075 -0.53005 -0.52889 -0.52829 -0.52724 -0.52507 -0.52357 -0.51863 -0.51550 -0.51132 -0.49745 -0.49255 -0.44175 -0.42821 -0.42523 -0.42465 -0.41924 -0.41632 -0.41482 -0.41173 -0.40810 -0.40762 -0.40032 -0.39929 -0.39491 -0.39198 -0.38885 -0.38285 -0.38016 -0.37708 -0.37387 -0.37057 -0.35527 -0.32871 -0.32463 -0.32403 -0.32316 -0.32247 -0.32114 -0.32064 -0.31918 -0.31841 -0.31769 -0.31548 -0.31503 -0.31286 -0.31187 -0.30989 -0.00582 0.01772 0.02374 0.02523 0.04810 0.05211 0.05795 0.06953 0.07668 0.08225 0.09125 0.09362 0.10159 0.10918 0.11302 0.11769 0.11795 0.12338 0.13587 0.13707 0.13991 0.14325 0.14742 0.15022 0.15104 0.15676 0.15891 0.16556 0.16907 0.17155 0.17376 0.17703 0.18229 0.18422 0.18738 0.19161 0.19393 0.19630 0.19846 0.20438 0.20638 0.20813 0.21419 0.21613 0.22293 0.22878 0.23051 0.23368 0.23810 0.24023 0.24427 0.24484 0.24794 0.25098 0.25435 0.25650 0.26046 0.26599 0.26706 0.27198 0.27395 0.27432 0.27531 0.27691 0.28261 0.28330 0.28570 0.28805 0.29260 0.29376 0.29880 0.30325 0.30386 0.30642 0.31559 0.31910 0.32579 0.33145 0.33772 0.34290 0.34529 0.35530 0.35879 0.36461 0.36883 0.37906 0.38263 0.39073 0.39574 0.40435 0.41826 0.42408 0.43565 0.44229 0.45895 0.46956 0.47665 0.48193 0.48875 0.49719 0.50514 0.51527 0.51613 0.52230 0.52570 0.53130 0.54374 0.54747 0.54927 0.55430 0.55598 0.56551 0.57163 0.57804 0.58050 0.58306 0.58557 0.59827 0.60013 0.60253 0.61149 0.61541 0.62124 0.63653 0.63816 0.64435 0.65268 0.65787 0.66707 0.67415 0.67478 0.67782 0.68525 0.69132 0.69678 0.70106 0.71959 0.72364 0.73419 0.75611 0.77813 0.83343 0.93755 0.94581 0.95873 0.96730 0.97770 0.98383 0.98683 0.99348 0.99515 1.00015 1.00246 1.00624 1.01332 1.02123 1.02330 1.02955 1.03034 1.03736 1.04153 1.04855 1.04976 1.06414 1.06582 1.06911 1.07796 1.08151 1.08711 1.09447 1.09949 1.10231 1.10920 1.11605 1.11869 1.12749 1.13072 1.14017 1.14362 1.14676 1.16213 1.16484 1.16992 1.18416 1.19850 1.21861 1.22626 1.23067 1.24598 1.26128 1.27174 1.27556 1.28204 1.28744 1.29166 1.30524 1.31217 1.31441 1.31980 1.32211 1.33354 1.33513 1.34057 1.34729 1.34831 1.35227 1.36103 1.36356 1.37011 1.37827 1.38202 1.38897 1.39836 1.40312 1.41052 1.41794 1.41969 1.42372 1.43321 1.44053 1.44644 1.44935 1.45365 1.46117 1.46784 1.47132 1.47487 1.47945 1.48993 1.49643 1.50239 1.50951 1.51690 1.51970 1.53299 1.53561 1.54326 1.55394 1.56092 1.57701 1.58670 1.58737 1.59979 1.60872 1.60949 1.62190 1.62759 1.63488 1.64043 1.65413 1.66185 1.67390 1.68512 1.69147 1.69648 1.70691 1.71554 1.72444 1.73384 1.74550 1.75236 1.75565 1.75653 1.77431 1.77764 1.79540 1.80225 1.80992 1.81436 1.83812 1.84321 1.86109 1.87155 1.93232 2.02886 2.03354 2.04100 2.05982 2.08778 2.11131 2.11370 2.12786 2.16266 2.19206 2.19813 2.21815 2.23431 2.25292 2.25858 2.28009 2.29720 2.30711 2.31455 2.31854 2.33389 2.34783 2.35362 2.37041 2.38852 2.39461 2.41260 2.41356 2.42090 2.43843 2.44333 2.46253 2.49670 2.52238 2.57379 2.60250 2.60325 2.61932 2.64247 2.66200 2.69431 2.69888 2.70695 2.71519 2.72166 2.73177 2.74069 2.74980 2.75119 2.75776 2.77251 2.78192 2.78518 2.78896 2.80968 2.81222 2.82118 2.82764 2.84186 2.85310 2.87142 2.88551 2.88897 2.97736 3.07198 3.07834 3.08005 3.08138 3.09674 3.09776 3.10113 3.10561 3.11179 3.11523 3.11794 3.12707 3.13076 3.13520 3.14172 3.14331 3.15389 3.15469 3.15897 3.16117 3.16635 3.17195 3.17505 3.17950 3.18179 3.18661 3.19907 3.20628 3.21569 3.23402 3.28720 3.29935 3.30546 3.31536 3.32294 3.32982 3.33571 3.34448 3.35023 3.35500 3.36205 3.37250 3.39228 3.39771 3.40575 3.57961 3.69489 3.70050 3.71291 3.71845 3.72155 3.72762 3.73653 3.74069 3.75144 3.76341 3.77130 3.78336 3.80109 3.80672 3.81590 3.82586 3.83058 3.84068 3.84739 3.87229 3.89147 3.90970 3.91280 3.91736 3.91891 3.93672 3.94069 3.94245 3.94684 3.94967 3.95688 3.96344 3.96483 3.96783 3.98041 3.98640 4.00536 4.00945 4.10124 4.20800 4.23379 4.40870 4.65023 4.67396 5.00998 5.01764 5.02560 5.02919 5.04091 5.04689 5.05663 5.06024 5.06343 5.07376 5.11243 5.13280 5.18905 5.20801 5.26353 5.35245 5.37101 5.37959 5.39039 5.39918 5.40684 5.42986 5.43503 5.43820 5.44862 5.45363 5.48221 5.52527 5.53478 5.54484 5.65235 5.66378 5.66772 5.68194 5.68937 5.69405 5.70052 5.70683 5.71252 5.71942 5.72169 5.74410 5.75775 5.78717 5.82210 6.35016 6.36990 6.43496 6.43802 6.45863 6.47999 6.51383 6.65518 6.70088 14.59496 49.88161 49.89515 49.89722 49.90618 49.91575 49.92086 49.92860 49.93298 49.93665 49.94051 49.95197 49.96912 49.97858 49.99012 49.99646 66.84919 66.86491 66.87542 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.159791 -0.476279 -0.453495 -0.502663 -1.059451 0.372552 0.415440 -0.778955 0.333989 -0.858684 0.418544 0.434348 0.383889 -0.804756 0.410609 -0.738325 0.321655 -0.799856 0.408340 0.417048 -0.683208 0.300730 0.363149 -0.815145 0.434217 0.373366 -0.665644 0.391085 0.283580 -0.840782 0.426879 0.427239 -0.762358 0.415806 0.322826 -0.681449 0.340470 0.332111 -0.729961 0.397725 0.312045 -0.701793 0.391846 0.302608 -0.715807 0.401702 0.458382 0.316643 -1.00000 2.08727990e+00 1.24946228e-01 1.04368855e+00 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 5.3053 0.3176 2.6528 5.9401 -156.8445 -194.6569 -164.2704 -0.2669 1.8025 -4.7386 15.0794 -22.7330 7.6535 -0.2669 1.8025 -4.7386 177.2296 -83.2513 65.4616 17.4629 13.5521 -10.6152 -6.1919 -35.8135 -36.9437 6.8682 -3884.8312 -4067.7203 -2675.3135 -102.5290 -145.2055 -55.4038 -19.9558 74.6271 -117.2806 -1360.2344 -1283.3050 -1159.4115 106.4412 54.3290 56.8272 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) 0 1-A -1471.4936382 4.439E-9 1.679E-5 -2.7046112,10.6089368,-7.9043256,-2.636911,10.9404346,4.2770066 C01 [X(B1F3H29O15)] 0.6051534 -2.2232799 -0.3904494 0.000050492 0.000034790 0.000009920 -0.000004699 -0.000002999 -0.000017690 -0.000033326 -0.000028354 -0.000010673 -0.000010861 -0.000000934 -0.000000078 0.000008602 0.000011483 0.000026834 -0.000001257 0.000000811 -0.000000180 0.000006226 0.000006155 -0.000017479 -0.000002164 -0.000009839 -0.000017682 0.000003061 0.000003196 0.000007408 -0.000021896 0.000025845 0.000015418 -0.000004821 -0.000031292 0.000022947 0.000003085 0.000009339 0.000001377 0.000005404 -0.000003414 -0.000021773 0.000003207 0.000002999 -0.000001348 -0.000009878 -0.000006203 -0.000008848 -0.000005201 0.000004427 0.000018164 -0.000002468 0.000006659 -0.000013817 0.000022274 0.000010003 -0.000036808 -0.000009598 0.000012939 0.000026539 -0.000011376 -0.000010620 0.000029429 -0.000011553 0.000011236 -0.000004608 0.000003205 -0.000001758 0.000000548 0.000010770 -0.000031249 0.000008102 -0.000008483 0.000004221 -0.000025152 0.000015956 0.000006722 0.000033528 0.000005424 -0.000003101 -0.000008518 -0.000021210 -0.000006829 -0.000001534 -0.000003823 -0.000004163 0.000013534 0.000012853 0.000002962 -0.000002160 0.000007756 0.000088510 -0.000025718 -0.000036717 -0.000071541 -0.000003797 -0.000004508 -0.000013745 0.000011760 -0.000006307 -0.000010819 -0.000005719 0.000025785 0.000004699 0.000000282 0.000001022 -0.000004520 0.000006959 0.000005461 -0.000001246 0.000005772 -0.000011807 -0.000000655 -0.000007364 -0.000000364 -0.000003330 -0.000000461 0.000002974 -0.000010609 0.000018578 -0.000009088 0.000001030 -0.000024518 -0.000000462 0.000002379 0.000000581 -0.000001931 -0.000000101 -0.000000283 0.000025783 -0.000004489 -0.000003818 0.000002948 0.000000870 0.000003481 0.000020410 -0.000005054 -0.000014147 -0.000004872 0.000003947 0.000004399 0.000004976 0.000004161 0.000000267 -0.000009007 0.000007481 0.000008350 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; Gaussian 16 GINC-GARGANTA LAMSABHI Optimization 14H2OBF3OH CONF223 water EM64L-G16RevC.01 138 C1[X(BF3H29O15)] RB3LYP 6-311+G(d,p) Freq #P Geom=AllCheck Guess=TCheck SCRF=Check GenChk RB3LYP/6-311+G(d,p) Freq 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; Optimization 14H2OBF3OH CONF223 water Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 11 19 19 19 16 1 1 16 1 16 1 1 1 16 1 16 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 1 11.0093053 18.9984033 18.9984033 18.9984033 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 3 1 1 1 0 1 1 0 1 0 1 1 1 0 1 0 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 1 2.7500000 6.7500000 6.7500000 6.7500000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) Structure from the checkpoint file: "/home/lamsabhi/diver/BF3-H2O/14H2OBF3OH/water/CONF223/opt-b3lyp.chk" Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 R51 1 1 1 1 5 5 5 6 7 7 8 8 8 10 10 10 11 12 13 14 14 15 16 18 18 18 18 20 21 21 21 23 24 24 27 27 27 30 30 30 33 33 36 36 37 39 39 42 42 45 45 2 3 4 5 19 31 47 14 16 39 9 12 32 11 13 26 16 33 36 15 25 42 17 19 20 28 40 24 22 23 46 30 25 26 28 29 34 31 32 43 34 35 37 38 45 40 41 43 44 46 48 1.4296 1.4185 1.4483 1.4292 1.8431 1.8233 0.9788 0.9772 0.9833 1.7961 0.9704 0.9827 1.8143 0.9844 0.978 1.8654 1.7926 1.7936 1.8977 0.9817 1.8269 1.8074 0.9709 0.9792 0.9871 1.76 1.7908 1.7793 0.9706 0.9806 1.8006 1.8375 0.9821 0.9762 0.986 0.9656 1.7722 0.9814 0.983 1.7512 0.9852 0.9651 0.9714 0.971 2.1067 0.984 0.9651 0.9855 0.9651 0.9845 0.9672 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 2 2 2 3 3 4 1 1 1 19 19 31 9 9 12 11 11 13 6 6 15 7 7 11 19 19 19 20 20 28 5 22 22 23 20 20 25 28 28 29 23 23 23 31 31 32 5 12 12 34 13 13 37 7 7 40 15 15 43 37 37 46 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 10 10 10 14 14 14 16 16 16 18 18 18 18 18 18 19 21 21 21 24 24 24 27 27 27 30 30 30 30 30 30 31 33 33 33 36 36 36 39 39 39 42 42 42 45 45 45 3 4 5 4 5 5 19 31 47 31 47 47 12 32 32 13 26 26 15 25 25 11 17 17 20 28 40 28 40 40 18 23 46 46 25 26 26 29 34 34 31 32 43 32 43 43 30 34 35 35 37 38 38 40 41 41 43 44 44 46 48 48 108.1784 106.1886 112.9609 107.5234 109.8899 111.857 136.9845 116.9846 112.1102 78.4721 93.1496 115.0151 104.8542 91.1987 105.6889 106.1204 114.5787 138.9044 104.835 94.2382 99.3522 102.5438 104.8018 93.5083 102.8251 103.2357 97.8948 111.6127 101.9874 134.5811 160.5161 103.2561 97.5852 94.8625 113.2591 97.2541 104.9385 104.4439 105.9344 100.9881 87.7603 108.2701 116.9071 103.4031 115.3196 119.961 168.0175 97.7319 110.9917 105.2072 90.3005 94.9387 103.6211 101.5904 109.6775 105.1426 98.9776 104.6184 105.4206 87.8964 78.5315 104.1434 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 A92 A93 A94 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 21 16 10 8 10 14 18 21 14 10 18 8 27 36 18 30 21 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 46 7 11 12 13 15 20 23 25 26 28 32 34 37 40 43 46 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 45 39 16 33 36 42 24 30 24 24 27 30 33 45 39 42 45 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 1 3 1 2 1 1 4 1 3 3 6 1 1 1 2 6 1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 -2 178.5151 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically 169.285 178.557 168.4836 176.2949 170.8875 167.2754 176.7013 173.4201 182.3171 164.7446 174.2304 153.3803 172.8139 172.9356 173.7903 176.9813 175.8639 185.0838 192.8029 183.6489 173.6171 191.1194 182.7508 187.4869 182.6819 180.319 176.1366 197.6167 180.8049 185.4982 180.9072 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 2 2 2 3 3 3 4 4 4 1 31 47 1 19 47 9 9 9 12 12 12 9 9 32 32 13 13 26 26 11 11 13 13 11 11 26 26 6 6 15 15 6 6 25 25 11 11 17 17 20 28 40 19 19 28 28 40 40 19 19 20 20 40 40 19 19 20 20 28 28 22 22 22 46 46 46 22 22 23 23 28 28 29 29 23 32 43 23 23 31 31 32 32 13 13 38 38 1 1 1 1 1 1 1 1 1 5 5 5 5 5 5 8 8 8 8 8 8 8 8 8 8 10 10 10 10 10 10 10 10 10 10 10 10 14 14 14 14 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 18 21 21 21 21 21 21 21 21 21 21 27 27 27 27 30 30 30 30 30 30 30 30 30 36 36 36 36 5 5 5 5 5 5 5 5 5 19 19 19 31 31 31 30 30 30 30 30 30 33 33 33 33 16 16 16 16 24 24 24 24 36 36 36 36 24 24 24 24 42 42 42 42 39 39 39 39 19 19 19 24 24 24 24 24 24 27 27 27 27 27 27 39 39 39 39 39 39 30 30 30 30 30 30 45 45 45 45 33 33 33 33 31 31 31 42 42 42 42 42 42 45 45 45 45 19 31 47 19 31 47 19 31 47 18 18 18 30 30 30 23 31 43 23 31 43 34 35 34 35 7 17 7 17 20 25 20 25 37 38 37 38 20 26 20 26 43 44 43 44 40 41 40 41 5 5 5 25 26 25 26 25 26 29 34 29 34 29 34 7 41 7 41 7 41 31 32 43 31 32 43 37 48 37 48 12 35 12 35 5 5 5 15 44 15 44 15 44 46 48 46 48 65.0519 167.5852 -56.4388 -55.8518 46.6815 -177.3425 -175.2002 -72.6669 63.3091 -156.515 86.0834 -28.8139 -1.5375 135.6462 -136.2618 -63.3214 25.4667 153.058 -167.5983 -78.8103 48.781 -97.5959 153.3851 -2.9632 -111.9822 162.585 57.4578 -6.1836 -111.3108 49.5558 164.7792 -118.4772 -3.2538 -169.1413 -65.5714 -9.0386 94.5314 92.4816 -11.0025 -13.0662 -116.5504 -33.7831 -141.8174 62.2152 -45.8192 -35.7758 74.6137 60.6521 171.0415 -4.3165 -120.5231 99.961 -76.4976 31.6361 32.4478 140.5814 -175.6669 -67.5333 56.1887 -49.526 -53.7224 -159.4371 170.4331 64.7184 -31.6843 -145.3186 72.7041 -40.9303 -147.0873 99.2783 -34.7381 66.6608 -149.288 62.5929 163.9918 -51.957 -32.398 45.0576 -136.2152 -58.7596 74.1389 -172.5973 -33.5833 79.6804 58.6432 -49.6091 177.4931 54.2671 161.9258 -45.0281 62.6306 -172.3942 -64.7355 123.8281 17.7262 29.555 -76.5469 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically Berny optimization. local minimum Step number 1 out of a maximum of 2 All quantities printed in internal units (Hartrees-Bohrs-Radians) Second derivative matrix not updated -- analytic derivatives used. 0.00018 0.00038 0.00051 0.00054 0.00058 0.00071 0.00116 0.00130 0.00196 0.00225 0.00241 0.00257 0.00268 0.00342 0.00352 0.00396 0.00411 0.00432 0.00472 0.00483 0.00509 0.00555 0.00568 0.00579 0.00619 0.00627 0.00645 0.00696 0.00729 0.00748 0.00794 0.00850 0.00880 0.00890 0.00944 0.00995 0.01023 0.01058 0.01110 0.01134 0.01162 0.01223 0.01264 0.01272 0.01287 0.01338 0.01356 0.01406 0.01415 0.01431 0.01489 0.01525 0.01534 0.01579 0.01598 0.01612 0.01660 0.01722 0.01763 0.01781 0.01793 0.01856 0.01911 0.01942 0.01985 0.02033 0.02074 0.02142 0.02343 0.02439 0.02639 0.02837 0.02973 0.03201 0.03514 0.03962 0.04216 0.04259 0.04427 0.04922 0.05299 0.05553 0.06190 0.06367 0.06391 0.06594 0.06631 0.06754 0.06795 0.07029 0.07200 0.07485 0.07686 0.08440 0.08835 0.09233 0.13991 0.14993 0.16467 0.16916 0.19822 0.20282 0.23081 0.26552 0.29424 0.32983 0.37323 0.39249 0.41645 0.42666 0.43636 0.43754 0.44238 0.44538 0.44773 0.45093 0.45466 0.45575 0.45927 0.45972 0.46319 0.46652 0.46923 0.47842 0.48391 0.49280 0.49434 0.49628 0.49782 0.49979 0.51127 0.52574 0.52658 0.52681 0.52685 0.53355 0.53482 0.69416 Angle between quadratic step and forces= 79.04 degrees. 1 2 3 0.00189024 0.00000499 0.00000000 0.00000329 0.00000129 0.00000129 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 R51 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 A92 A93 A94 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 2.70148 2.68054 2.73690 2.70079 3.48296 3.44557 1.84975 1.84673 1.85807 3.39408 1.83378 1.85711 3.42852 1.86030 1.84816 3.52505 3.38745 3.38936 3.58605 1.85506 3.45236 3.41556 1.83471 1.85040 1.86533 3.32591 3.38415 3.36238 1.83414 1.85316 3.40261 3.47228 1.85593 1.84476 1.86326 1.82468 3.34900 1.85456 1.85765 3.30923 1.86185 1.82374 1.83573 1.83487 3.98117 1.85952 1.82378 1.86238 1.82375 1.86042 1.82772 1.88807 1.85334 1.97154 1.87664 1.91794 1.95227 2.39083 2.04177 1.95669 1.36960 1.62577 2.00739 1.83005 1.59172 1.84462 1.85215 1.99978 2.42434 1.82972 1.64477 1.73402 1.78973 1.82914 1.63203 1.79464 1.80180 1.70859 1.94801 1.78002 2.34888 2.80153 1.80216 1.70318 1.65566 1.97674 1.69740 1.83152 1.82289 1.84890 1.76257 1.53171 1.88967 2.04041 1.80472 2.01271 2.09371 2.93246 1.70574 1.93717 1.83621 1.57604 1.65699 1.80853 1.77309 1.91423 1.83509 1.72749 1.82594 1.83994 1.53408 1.37063 1.81765 3.11568 2.95458 3.11641 2.94059 3.07693 2.98255 2.91951 3.08402 3.02675 3.18203 2.87534 3.04089 2.67699 3.01617 3.01830 3.03321 3.08891 3.06940 3.23032 3.36504 3.20528 3.03019 3.33566 3.18960 3.27226 3.18840 3.14716 3.07416 3.44906 3.15564 3.23755 3.15743 1.13537 2.92491 -0.98504 -0.97480 0.81475 -3.09521 -3.05782 -1.26828 1.10495 -2.73170 1.50244 -0.50290 -0.02684 2.36747 -2.37822 -1.10517 0.44448 2.67137 -2.92514 -1.37550 0.85139 -1.70337 2.67708 -0.05172 -1.95446 2.83764 1.00283 -0.10792 -1.94274 0.86491 2.87594 -2.06782 -0.05679 -2.95207 -1.14444 -0.15775 1.64988 1.61411 -0.19203 -0.22805 -2.03419 -0.58963 -2.47518 1.08586 -0.79970 -0.62440 1.30226 1.05858 2.98524 -0.07534 -2.10352 1.74465 -1.33513 0.55215 0.56632 2.45361 -3.06597 -1.17868 0.98068 -0.86439 -0.93763 -2.78270 2.97462 1.12955 -0.55300 -2.53629 1.26893 -0.71437 -2.56716 1.73273 -0.60629 1.16345 -2.60557 1.09245 2.86220 -0.90682 -0.56545 0.78640 -2.37740 -1.02555 1.29397 -3.01239 -0.58614 1.39069 1.02352 -0.86584 3.09784 0.94714 2.82614 -0.78589 1.09311 -3.00885 -1.12985 2.16121 0.30938 0.51583 -1.33599 -0.00002 0.00004 0.00000 -0.00001 -0.00001 0.00003 0.00001 0.00000 0.00000 0.00000 0.00001 0.00000 -0.00000 0.00002 -0.00000 0.00001 -0.00001 0.00001 0.00000 0.00001 0.00001 -0.00001 0.00001 0.00001 -0.00002 -0.00000 -0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00002 -0.00002 -0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 0.00002 0.00001 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00001 0.00000 0.00000 0.00000 -0.00000 -0.00001 0.00000 -0.00001 -0.00000 0.00002 0.00000 -0.00001 0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00002 -0.00001 -0.00002 -0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 -0.00000 0.00001 -0.00000 0.00001 0.00000 -0.00001 -0.00001 -0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00002 -0.00000 0.00001 0.00000 0.00001 -0.00000 -0.00000 -0.00001 0.00000 0.00000 -0.00001 0.00000 0.00000 -0.00002 -0.00001 -0.00001 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00001 -0.00001 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00002 0.00001 -0.00000 -0.00001 0.00000 0.00001 -0.00001 -0.00001 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00001 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00001 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 0.00000 -0.00001 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00001 0.00001 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00001 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00001 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00008 0.00021 -0.00001 -0.00010 -0.00163 0.00165 0.00000 0.00010 -0.00002 0.00081 0.00003 -0.00003 0.00051 0.00006 0.00003 0.00080 -0.00024 0.00049 -0.00099 -0.00001 0.00067 0.00030 0.00002 0.00008 -0.00010 -0.00042 -0.00092 0.00057 -0.00002 0.00016 0.00037 -0.00273 -0.00009 -0.00003 0.00003 -0.00000 -0.00145 -0.00010 0.00003 0.00172 0.00010 -0.00001 -0.00015 0.00002 0.00800 0.00009 0.00000 -0.00010 0.00001 -0.00002 0.00000 -0.00004 -0.00002 0.00005 -0.00006 -0.00005 0.00011 -0.00064 -0.00056 0.00017 0.00006 0.00045 0.00071 -0.00029 -0.00049 0.00043 0.00031 -0.00053 0.00007 0.00009 -0.00074 -0.00017 -0.00031 0.00008 -0.00028 0.00009 0.00088 -0.00020 0.00190 -0.00063 -0.00181 0.00036 -0.00002 0.00028 -0.00058 0.00008 0.00009 0.00002 0.00006 0.00079 0.00144 0.00124 0.00037 0.00261 -0.00033 -0.00169 -0.00171 -0.00012 -0.00015 0.00178 0.00014 0.00232 0.00022 0.00009 -0.00095 -0.00071 -0.00006 -0.00059 -0.00077 0.00002 -0.00229 -0.00278 0.00000 0.00038 0.00035 -0.00115 0.00007 0.00006 -0.00029 0.00129 -0.00111 0.00013 -0.00024 -0.00113 0.00016 -0.00232 0.00023 -0.00011 0.00070 0.00069 0.00015 -0.00062 -0.00034 0.00062 0.00021 -0.00088 -0.00051 0.00064 -0.00016 0.00018 -0.00002 0.00299 0.00054 0.00029 -0.00083 -0.00049 -0.00155 -0.00086 -0.00043 -0.00150 -0.00081 -0.00040 -0.00147 -0.00078 -0.00481 -0.00382 -0.00445 0.01691 0.01607 0.01645 0.00121 0.00226 -0.00202 0.00178 0.00283 -0.00146 0.00008 -0.00061 -0.00054 -0.00123 -0.00012 -0.00015 0.00070 0.00068 -0.00043 -0.00026 0.00102 0.00119 0.00003 0.00013 -0.00135 -0.00125 -0.00051 -0.00036 -0.00039 -0.00024 0.00309 0.00345 0.00224 0.00259 -0.00142 -0.00205 -0.00164 -0.00226 0.00521 0.00278 0.00452 -0.00181 -0.00175 -0.00032 -0.00026 -0.00151 -0.00146 0.00390 0.00197 0.00262 0.00069 0.00346 0.00153 0.00133 0.00266 0.00126 0.00260 0.00112 0.00246 0.00092 0.00119 0.00173 0.00120 0.00146 0.00201 -0.00043 -0.00362 -0.00038 -0.00357 0.00067 0.00261 -0.00009 0.00185 -0.01561 -0.01627 -0.01239 -0.00343 -0.00453 -0.00561 -0.00672 -0.00163 -0.00274 0.00024 -0.00111 -0.00011 -0.00146 -0.00008 0.00021 -0.00001 -0.00010 -0.00163 0.00165 0.00000 0.00010 -0.00002 0.00081 0.00003 -0.00003 0.00051 0.00006 0.00003 0.00080 -0.00024 0.00049 -0.00098 -0.00001 0.00067 0.00030 0.00002 0.00008 -0.00010 -0.00042 -0.00092 0.00057 -0.00002 0.00016 0.00037 -0.00273 -0.00009 -0.00003 0.00002 -0.00000 -0.00145 -0.00010 0.00003 0.00172 0.00010 -0.00001 -0.00015 0.00002 0.00800 0.00009 0.00000 -0.00010 0.00001 -0.00002 0.00000 -0.00004 -0.00002 0.00005 -0.00006 -0.00005 0.00011 -0.00064 -0.00056 0.00017 0.00006 0.00045 0.00071 -0.00029 -0.00049 0.00043 0.00031 -0.00053 0.00007 0.00009 -0.00074 -0.00017 -0.00031 0.00008 -0.00028 0.00008 0.00088 -0.00020 0.00190 -0.00063 -0.00181 0.00036 -0.00002 0.00028 -0.00058 0.00008 0.00009 0.00002 0.00006 0.00079 0.00144 0.00124 0.00037 0.00261 -0.00033 -0.00169 -0.00172 -0.00013 -0.00015 0.00178 0.00014 0.00232 0.00022 0.00008 -0.00095 -0.00071 -0.00006 -0.00059 -0.00077 0.00002 -0.00229 -0.00278 -0.00000 0.00038 0.00035 -0.00115 0.00007 0.00006 -0.00029 0.00129 -0.00111 0.00013 -0.00024 -0.00114 0.00016 -0.00232 0.00023 -0.00011 0.00070 0.00069 0.00015 -0.00062 -0.00034 0.00062 0.00021 -0.00088 -0.00051 0.00064 -0.00016 0.00018 -0.00003 0.00299 0.00054 0.00030 -0.00083 -0.00049 -0.00155 -0.00086 -0.00043 -0.00150 -0.00081 -0.00040 -0.00147 -0.00078 -0.00480 -0.00382 -0.00445 0.01691 0.01607 0.01645 0.00121 0.00226 -0.00202 0.00177 0.00283 -0.00146 0.00008 -0.00061 -0.00054 -0.00123 -0.00012 -0.00015 0.00070 0.00068 -0.00043 -0.00026 0.00102 0.00119 0.00003 0.00013 -0.00135 -0.00125 -0.00051 -0.00036 -0.00039 -0.00024 0.00309 0.00345 0.00224 0.00259 -0.00142 -0.00205 -0.00164 -0.00226 0.00521 0.00278 0.00452 -0.00181 -0.00175 -0.00032 -0.00026 -0.00151 -0.00146 0.00390 0.00197 0.00262 0.00069 0.00346 0.00153 0.00133 0.00267 0.00126 0.00260 0.00112 0.00246 0.00093 0.00118 0.00173 0.00120 0.00146 0.00201 -0.00043 -0.00362 -0.00038 -0.00357 0.00067 0.00261 -0.00009 0.00185 -0.01561 -0.01627 -0.01239 -0.00343 -0.00453 -0.00561 -0.00671 -0.00164 -0.00275 0.00024 -0.00111 -0.00010 -0.00146 2.70140 2.68075 2.73690 2.70069 3.48132 3.44722 1.84975 1.84683 1.85805 3.39489 1.83382 1.85708 3.42903 1.86036 1.84818 3.52586 3.38721 3.38985 3.58506 1.85505 3.45303 3.41587 1.83474 1.85048 1.86524 3.32549 3.38323 3.36295 1.83412 1.85332 3.40298 3.46955 1.85584 1.84473 1.86329 1.82468 3.34755 1.85446 1.85769 3.31095 1.86195 1.82372 1.83558 1.83490 3.98917 1.85961 1.82379 1.86228 1.82376 1.86040 1.82772 1.88803 1.85332 1.97159 1.87657 1.91789 1.95239 2.39019 2.04120 1.95686 1.36966 1.62622 2.00810 1.82976 1.59123 1.84505 1.85246 1.99925 2.42441 1.82981 1.64403 1.73385 1.78941 1.82921 1.63175 1.79472 1.80268 1.70839 1.94990 1.77939 2.34707 2.80190 1.80214 1.70346 1.65508 1.97682 1.69750 1.83155 1.82295 1.84970 1.76401 1.53294 1.89004 2.04302 1.80439 2.01102 2.09200 2.93233 1.70560 1.93895 1.83635 1.57836 1.65721 1.80861 1.77214 1.91352 1.83502 1.72690 1.82517 1.83996 1.53179 1.36786 1.81765 3.11605 2.95494 3.11526 2.94067 3.07699 2.98225 2.92079 3.08291 3.02688 3.18179 2.87420 3.04105 2.67467 3.01640 3.01818 3.03391 3.08960 3.06956 3.22971 3.36471 3.20590 3.03040 3.33478 3.18910 3.27290 3.18824 3.14734 3.07414 3.45205 3.15618 3.23785 3.15660 1.13488 2.92336 -0.98591 -0.97523 0.81324 -3.09602 -3.05822 -1.26974 1.10418 -2.73651 1.49862 -0.50734 -0.00993 2.38354 -2.36177 -1.10395 0.44674 2.66935 -2.92337 -1.37267 0.84993 -1.70329 2.67646 -0.05226 -1.95569 2.83752 1.00268 -0.10722 -1.94206 0.86448 2.87568 -2.06679 -0.05560 -2.95205 -1.14431 -0.15911 1.64863 1.61360 -0.19239 -0.22844 -2.03443 -0.58653 -2.47174 1.08810 -0.79710 -0.62583 1.30021 1.05694 2.98297 -0.07013 -2.10074 1.74916 -1.33694 0.55041 0.56600 2.45335 -3.06748 -1.18013 0.98458 -0.86243 -0.93501 -2.78201 2.97808 1.13108 -0.55167 -2.53362 1.27019 -0.71177 -2.56604 1.73519 -0.60537 1.16463 -2.60384 1.09365 2.86366 -0.90481 -0.56588 0.78278 -2.37778 -1.02912 1.29464 -3.00978 -0.58623 1.39253 1.00791 -0.88211 3.08545 0.94371 2.82160 -0.79150 1.08640 -3.01048 -1.13259 2.16145 0.30827 0.51573 -1.33745 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000044 0.000007 0.009961 0.001891 0.000450 0.000300 0.001800 0.001200 YES YES NO NO -4.879697e-07 6-311+G(d,p) (5D, 7F) 0.10000e-02 0.10000e-05 F 611 A 592 A 592 916 611 91 91 2087.3848596532 48 48 48 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=141 Grimme-D3(BJ) -0.0589086310 PCM SMD-Coulomb. Total charges None Matrix inversion Water 78.355300 1.777849 0.000000 1.429564 0.000000 1.418481 2.306729 0.000000 1.448307 2.301244 2.312318 0.000000 1.429197 2.383341 2.331118 2.383573 0.000000 5.520793 6.501634 6.342232 5.424535 4.397805 0.000000 3.984773 3.260297 4.882564 5.030790 3.569580 6.589872 0.000000 3.906074 5.033336 2.844212 4.558264 3.895258 6.529155 6.802997 0.000000 3.042621 4.116965 1.886320 3.753130 3.264165 6.448481 6.128335 0.970396 0.000000 3.603448 3.661322 4.939846 3.868640 2.847990 4.054987 3.109571 6.703725 6.107579 0.000000 3.521692 3.224324 4.830470 4.012968 2.945565 4.963776 2.223884 6.813198 6.146305 0.984428 0.000000 4.294644 5.270630 3.248670 5.177473 4.144068 6.883449 6.655398 0.982740 1.548031 6.916301 6.943130 0.000000 3.518521 3.581841 4.919305 3.426485 3.072751 4.226956 3.740103 6.866508 6.216419 0.978002 1.568511 7.201164 0.000000 6.086233 7.044453 6.834907 6.167957 4.839005 0.977250 6.789814 6.775998 6.787469 4.518637 5.364434 7.014959 4.860422 0.000000 5.958204 7.028103 6.517880 6.131965 4.703822 1.552387 6.943121 6.097338 6.221896 4.950382 5.726560 6.307620 5.321612 0.981655 0.000000 3.736774 2.845655 4.799072 4.572482 3.549735 6.584262 0.983250 7.016263 6.262173 2.764243 1.792562 6.996276 3.182373 6.912385 7.140948 0.000000 2.909438 1.891518 3.925950 3.794167 3.003123 6.556440 1.548281 6.308081 5.496281 2.931950 2.090192 6.347087 3.178721 6.960801 7.101694 0.970888 0.000000 4.020778 4.486114 4.415534 5.167685 2.785432 4.799240 3.486949 4.759003 4.540936 3.859965 3.818538 4.451971 4.647614 4.673201 4.408804 4.129163 4.099043 0.000000 3.048222 3.610573 3.478644 4.213329 1.843102 4.655423 3.272686 4.146531 3.790609 3.449443 3.409571 3.980874 4.102320 4.725301 4.469842 3.742963 3.515637 0.979189 0.000000 4.326590 4.832780 4.941894 5.282148 2.956943 4.045859 3.655834 5.352984 5.147082 3.380116 3.520509 5.162172 4.219558 3.865764 3.735570 4.205370 4.307095 0.987092 1.536966 0.000000 3.651707 4.951712 4.023279 2.900605 3.525636 3.873940 6.923982 4.454615 4.184290 4.891821 5.519259 5.255952 4.547019 4.661351 4.469533 6.668341 6.102938 5.661037 4.909898 5.517914 0.000000 2.865144 4.101116 3.327457 1.953954 3.032213 4.368728 6.340294 4.335936 3.865491 4.503033 5.009757 5.127128 4.088325 5.171475 5.040288 6.012325 5.374794 5.497237 4.648440 5.440573 0.970584 0.000000 3.518616 4.911601 3.712944 3.157083 3.169260 3.690141 6.685493 3.689708 3.543361 4.909473 5.496029 4.437434 4.754500 4.327320 3.960229 6.567178 6.012995 4.997308 4.295229 4.920048 0.980650 1.529774 0.000000 5.080115 5.572997 6.001276 5.658468 3.718248 3.016868 4.287241 6.620126 6.390300 2.832922 3.327517 6.608782 3.647417 2.807280 3.123441 4.591812 4.877976 2.754506 3.034707 1.779296 5.546358 5.584911 5.154935 0.000000 5.325888 6.017983 6.197084 5.730823 3.959787 2.134599 5.147502 6.562782 6.421231 3.288477 3.966482 6.637877 3.930567 1.826911 2.210004 5.377752 5.565701 3.289757 3.484162 2.347462 5.120538 5.319905 4.730457 0.982118 0.000000 4.483705 4.879238 5.562623 4.964272 3.233858 3.069092 3.768168 6.573985 6.214550 1.865377 2.444657 6.652244 2.680638 3.163275 3.574144 3.895800 4.164874 2.975061 2.978940 2.134836 5.152174 5.067900 4.896685 0.976206 1.553007 0.000000 5.531780 6.363573 5.271189 6.588906 4.502157 5.766195 6.089308 3.960713 4.320720 6.330993 6.442081 3.371561 6.986348 5.439018 4.718360 6.739509 6.526488 2.744912 3.108936 3.256944 6.276581 6.381752 5.350682 4.730252 4.801700 5.233883 0.000000 4.883056 5.626777 4.826921 5.984956 3.757065 5.253880 5.148576 4.078006 4.223447 5.409262 5.487228 3.585536 6.105169 4.978849 4.389073 5.798200 5.635629 1.759994 2.201260 2.313378 5.916887 5.938218 5.056738 3.894086 4.089108 4.343930 0.985997 0.000000 5.456542 6.464332 5.188873 6.345849 4.424818 5.243930 6.522784 3.618972 4.088196 6.331910 6.573140 3.214768 6.901146 4.946447 4.131727 7.072544 6.804304 3.141248 3.334199 3.483205 5.649056 5.870718 4.694195 4.737318 4.619282 5.225504 0.965579 1.542556 0.000000 3.594745 4.937364 3.555033 3.959879 2.790774 3.772414 6.095579 2.774756 2.872558 4.935099 5.386419 3.200945 5.135014 4.034642 3.402183 6.250168 5.775721 3.637212 3.108255 3.717258 2.790551 3.055570 1.837451 4.419045 4.099414 4.435403 3.520351 3.309081 2.866735 0.000000 2.780637 4.058310 2.991360 3.310825 1.823319 3.685293 5.144233 3.011722 2.811082 4.059320 4.443951 3.361831 4.293082 4.015924 3.565390 5.271657 4.802242 2.997914 2.319123 3.091640 2.828806 2.825111 2.049002 3.850092 3.703006 3.729217 3.589386 3.124501 3.162585 0.981391 0.000000 3.631479 4.959244 3.205130 4.122997 3.089616 4.755069 6.347373 1.814295 2.075331 5.587012 5.912842 2.285111 5.782217 4.988447 4.307013 6.539887 5.974438 3.910055 3.346302 4.214884 3.275022 3.413356 2.339891 5.184019 4.961641 5.199295 3.385947 3.339835 2.777123 0.983028 1.541663 0.000000 5.360303 6.063823 4.461001 6.498920 4.994703 7.683795 6.673198 2.773866 3.164994 7.516781 7.415938 1.793574 7.993480 7.620720 6.899758 7.232556 6.731395 4.296415 4.167078 5.147794 6.775491 6.646523 5.907444 6.814158 6.987838 7.019102 2.752814 3.153798 3.058951 4.360437 4.411259 3.627099 0.000000 5.322842 6.083305 4.645182 6.465939 4.701486 6.987187 6.360249 3.038639 3.442407 7.040572 7.002719 2.159423 7.588442 6.838763 6.112021 6.969510 6.566420 3.605224 3.629624 4.396252 6.543063 6.493888 5.634504 6.040856 6.192504 6.341426 1.772212 2.252193 2.173800 3.931444 3.989410 3.362668 0.985249 0.000000 6.256352 6.997234 5.292314 7.333990 5.897760 8.317394 7.615029 3.257973 3.823408 8.425127 8.354817 2.321302 8.901436 8.203695 7.418226 8.191615 7.695963 5.121831 5.060905 5.935535 7.408141 7.351446 6.513882 7.573683 7.689579 7.842773 3.180924 3.791189 3.416614 4.961989 5.154745 4.188644 0.965080 1.549492 0.000000 3.739926 3.979402 5.031966 2.891397 3.824700 4.752648 5.308966 7.065389 6.381187 2.846672 3.337031 7.621881 1.897654 5.612961 6.033145 4.610766 4.317423 6.073110 5.355968 5.731199 3.884647 3.348166 4.458581 5.208729 5.229477 4.309647 8.062126 7.291232 7.809790 5.476497 4.794118 6.071065 8.755042 8.475308 9.624641 0.000000 4.021697 4.536843 5.245714 3.170518 3.858472 3.937268 5.732565 6.931718 6.353954 2.954706 3.669573 7.516061 2.136374 4.843075 5.286429 5.151128 4.897367 5.970721 5.306204 5.533915 3.355401 3.043658 3.948762 4.860185 4.711738 4.046345 7.785929 7.060976 7.444161 5.048717 4.476498 5.743943 8.682908 8.334316 9.512364 0.971425 0.000000 2.904960 3.245778 4.134367 1.936712 3.231726 4.932921 5.100433 6.261388 5.534298 3.028719 3.389192 6.843586 2.204798 5.781619 6.051737 4.436970 3.955024 5.744706 4.929156 5.547398 3.390914 2.681072 3.928001 5.324811 5.370098 4.462371 7.599822 6.868996 7.349038 4.946434 4.253861 5.425397 8.042655 7.842453 8.907461 0.970973 1.526668 0.000000 4.889465 4.478958 5.464442 6.142117 4.171307 6.868972 1.796069 6.715280 6.233445 4.219631 3.569807 6.331658 5.043208 6.827924 6.832473 2.778250 3.163556 2.769772 3.022845 3.131236 7.620550 7.181488 7.166741 4.194547 5.101301 4.079946 5.101686 4.217961 5.736159 6.130517 5.302618 6.304358 5.897940 5.476015 6.763076 6.714921 6.963207 6.471448 0.000000 4.478585 4.360506 5.008376 5.735530 3.560816 6.092641 2.214570 5.984572 5.581424 3.929551 3.472190 5.608285 4.784549 6.014893 5.944388 3.111579 3.341625 1.790814 2.155815 2.217127 6.915614 6.560635 6.391713 3.508751 4.349639 3.505429 4.190705 3.275551 4.785148 5.247416 4.465782 5.447824 5.224984 4.709600 6.087928 6.424576 6.555041 6.151666 0.984014 0.000000 5.692065 5.295103 6.352286 6.871250 4.865601 7.014481 2.307520 7.519954 7.084243 4.454527 3.852819 7.125638 5.342162 6.886312 6.968621 3.233763 3.819946 3.209799 3.645830 3.351176 8.206049 7.822823 7.761582 4.135907 5.090904 4.117299 5.523655 4.643331 6.172171 6.713662 5.910582 6.973687 6.618092 6.109591 7.443388 7.128255 7.336304 7.001452 0.965105 1.547858 0.000000 6.026127 7.225334 6.189028 6.381965 4.854439 3.178017 7.412498 5.017279 5.391513 5.985520 6.607624 5.131085 6.391893 2.786483 1.807439 7.734238 7.553652 4.318254 4.394457 3.994062 4.647339 5.244139 3.854952 4.162985 3.488784 4.680360 3.572290 3.598842 2.778465 2.729059 3.272389 3.361209 5.647926 4.871250 6.006623 7.041604 6.377412 6.825970 7.042899 6.072834 7.310735 0.000000 5.122689 6.362812 5.219915 5.507144 4.024149 3.218297 6.826818 4.104387 4.427407 5.503400 6.071188 4.280624 5.863920 3.080458 2.189529 7.111496 6.837985 3.824447 3.723738 3.640448 3.927724 4.440860 3.058612 4.058685 3.506383 4.421938 3.209967 3.162386 2.389823 1.751167 2.345138 2.398405 4.973192 4.275712 5.414206 6.445453 5.853113 6.125480 6.561571 5.598026 6.943026 0.985529 0.000000 6.300286 7.400225 6.437714 6.843306 5.049920 3.714804 7.239873 5.223247 5.616681 6.139898 6.672642 5.154638 6.673408 3.155638 2.253597 7.675260 7.563012 3.953113 4.229291 3.666349 5.416684 5.916762 4.586004 4.013709 3.475113 4.675308 2.978387 3.061735 2.318791 3.198040 3.610636 3.714261 5.356910 4.487541 5.689263 7.539703 6.938418 7.324530 6.648660 5.673694 6.856133 0.965088 1.551926 0.000000 4.441360 5.356861 5.442488 3.974330 3.688373 1.886646 6.087279 6.289522 5.974411 3.246455 4.175305 6.811599 3.000488 2.838933 3.248566 5.821769 5.648836 5.133201 4.659159 4.541853 2.781269 3.032786 3.021684 3.713787 3.203517 3.240726 6.511627 5.894911 6.034678 3.823599 3.495197 4.720689 7.884294 7.367782 8.619061 2.977519 2.106744 3.177446 6.828082 6.181601 7.123224 4.467432 4.117555 5.084824 0.000000 4.026076 5.112960 4.861404 3.437803 3.441908 2.394844 6.320551 5.580152 5.281621 3.732638 4.564529 6.195278 3.429091 3.316886 3.462323 6.055273 5.728227 5.202422 4.610715 4.766309 1.800584 2.155344 2.122057 4.275494 3.776059 3.835377 6.315389 5.782680 5.766441 3.248077 3.029566 4.074260 7.426680 6.993080 8.132150 3.097816 2.292450 3.027129 7.051312 6.366887 7.460403 4.318637 3.823413 5.026503 0.984490 0.000000 2.013418 2.604355 3.196502 2.644783 0.978846 3.994812 3.209061 4.841454 4.235104 1.873621 2.088793 5.082386 2.161525 4.470717 4.531608 3.080701 2.727501 2.907737 2.133873 2.796614 3.752562 3.291815 3.549796 3.138840 3.446816 2.474997 5.014924 4.177208 4.956544 3.363305 2.406661 3.857205 5.835584 5.453662 6.741511 3.226197 3.265195 2.840738 4.020884 3.481465 4.581854 5.037549 4.327465 5.231558 3.203953 3.203465 0.000000 3.855449 4.663828 4.952941 3.644679 2.963465 2.090843 5.134801 5.998854 5.615672 2.353857 3.269011 6.423117 2.274908 2.879662 3.271513 4.908343 4.778879 4.319015 3.847536 3.729923 3.105538 3.137062 3.178402 2.972819 2.664436 2.383862 5.983329 5.271569 5.628012 3.625406 3.084851 4.494554 7.363189 6.834428 8.151633 2.783031 2.136246 2.921432 5.872904 5.252420 6.169847 4.433714 4.010681 4.901993 0.967185 1.539481 2.349077 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8654,-1.4601,-1.4103;-1.614,-2.5947,-.9676;.2491,-1.9276,-2.1529;-1.7272,-.7394,-2.3245;-.4198,-.6318,-.3343;-.7576,3.6132,.7642;-1.6067,-2.7412,2.2894;2.8283,-.7742,-2.4795;1.9879,-1.2583,-2.4473;-2.605,.0529,1.359;-2.6424,-.9058,1.5792;3.403,-1.2231,-1.8207;-3.2258,.1851,.6149;-.1456,3.8413,1.4912;.751,3.6845,1.1236;-2.4309,-2.677,1.757;-2.1421,-2.7949,.8376;1.1457,-.6244,1.9696;.7308,-.7853,1.0973;.6354,.1463,2.3161;-.6945,1.9407,-2.7295;-1.0923,1.0559,-2.762;.1731,1.7816,-2.3011;-.5524,1.3845,2.787;-.3865,2.2589,2.3718;-1.3144,1.0156,2.3009;3.7256,.0258,1.2943;2.7959,-.1752,1.5541;3.6499,.7729,.6873;1.4851,1.2453,-1.1318;.8257,.6397,-.73;2.0927,.637,-1.6082;4.3971,-1.9404,-.5115;4.21,-1.2658,.1818;5.3386,-1.8512,-.7039;-3.9554,.6209,-1.0818;-3.5559,1.505,-1.0321;-3.3064,.1048,-1.5869;-.0816,-2.7591,3.2378;.3997,-1.992,2.8528;-.2643,-2.5091,4.1519;2.3872,3.2406,.4971;2.1349,2.465,-.0562;2.8486,2.872,1.2604;-1.9622,2.7184,-.3793;-1.5049,2.5106,-1.226;-1.1616,-.3244,.2256;-1.8335,1.9255,.1595; 0.2125080 0.1874234 0.1734444 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 592 RedAO= T EigKep= 8.02D-05 NBF= 592 NBsUse= 592 1.00D-06 EigRej= -1.00D+00 NBFU= 592 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 604 602 603 604 604 MxSgAt= 48 MxSgA2= 48. 1 Closed 1 1 1 -1471.49363816530 -1471.49363817 1 1.466649468084e+03 -7.677212938867e+03 2.651730163879e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 11324620800 LenX= 11323862024 LenY= 11323488092 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. Using compressed storage, NAtomX= 48. Will process 49 centers per pass. Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 Minotr: Closed shell wavefunction. IDoAtm=111111111111111111111111111111111111111111111111 NEqPCM: Using equilibrium solvation (IEInf=0, Eps= 78.3553, EpsInf= 1.7778) Direct CPHF calculation. Differentiating once with respect to electric field. with respect to dipole field. Differentiating once with respect to nuclear coordinates. Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum. Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum. NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T. 14963 words used for storage of precomputed grid. Two-electron integrals replicated using symmetry. MDV= 11324620800 using IRadAn= 1. Solving linear equations simultaneously, MaxMat= 384. FoF2E skips out because all densities are zero. CalDSu exits because no D1Ps are significant. FoFJK: IHMeth= 1 ICntrl= 0 DoSepK=F KAlg= 0 I1Cent= 0 FoldK=F IRaf= 790000000 NMat= 144 IRICut= 360 DoRegI=T DoRafI=T ISym2E= 2 IDoP0=3 IntGTp=3. There are 147 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 144 vectors produced by pass 0 Test12= 4.56D-14 1.00D-09 XBig12= 7.32D+01 1.39D+00. AX will form 144 AO Fock derivatives at one time. 144 vectors produced by pass 1 Test12= 4.56D-14 1.00D-09 XBig12= 3.28D+00 1.50D-01. 144 vectors produced by pass 2 Test12= 4.56D-14 1.00D-09 XBig12= 4.19D-02 1.82D-02. 144 vectors produced by pass 3 Test12= 4.56D-14 1.00D-09 XBig12= 1.41D-04 8.38D-04. 144 vectors produced by pass 4 Test12= 4.56D-14 1.00D-09 XBig12= 2.60D-07 3.95D-05. 91 vectors produced by pass 5 Test12= 4.56D-14 1.00D-09 XBig12= 3.80D-10 1.36D-06. 10 vectors produced by pass 6 Test12= 4.56D-14 1.00D-09 XBig12= 3.70D-13 4.46D-08. 3 vectors produced by pass 7 Test12= 4.56D-14 1.00D-09 XBig12= 5.26D-16 2.42D-09. InvSVY: IOpt=1 It= 1 EMax= 7.11D-15 Solved reduced A of dimension 824 with 147 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 188.93 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 192.320 -0.580 187.496 0.664 1.022 186.969 178.953 0.078 174.816 0.820 0.929 174.704 (Enter /usr/local/gaussian/gaussian16/g16/l716.exe) PT25821.500S Wed Nov 6 03:58:21 2024 -24.64591 -24.64474 -24.64198 -19.12476 -19.12381 -19.12195 -19.12145 -19.12124 -19.12092 -19.12072 -19.11964 -19.11944 -19.11907 -19.11568 -19.11514 -19.11267 -19.11122 -19.11056 -6.85377 -1.19700 -1.15522 -1.15205 -1.02637 -1.02121 -1.01977 -1.01521 -1.01326 -1.01162 -1.00963 -1.00793 -1.00529 -1.00068 -0.99843 -0.99466 -0.99385 -0.99130 -0.98674 -0.57672 -0.53933 -0.53903 -0.53431 -0.53240 -0.53180 -0.53075 -0.53005 -0.52889 -0.52829 -0.52724 -0.52507 -0.52357 -0.51863 -0.51550 -0.51132 -0.49745 -0.49255 -0.44175 -0.42821 -0.42523 -0.42465 -0.41924 -0.41632 -0.41482 -0.41173 -0.40810 -0.40762 -0.40032 -0.39929 -0.39491 -0.39198 -0.38885 -0.38285 -0.38016 -0.37708 -0.37387 -0.37057 -0.35527 -0.32871 -0.32463 -0.32403 -0.32316 -0.32247 -0.32114 -0.32064 -0.31918 -0.31841 -0.31769 -0.31548 -0.31503 -0.31286 -0.31187 -0.30989 -0.00582 0.01772 0.02374 0.02523 0.04810 0.05211 0.05795 0.06953 0.07668 0.08225 0.09125 0.09362 0.10159 0.10918 0.11302 0.11769 0.11795 0.12338 0.13587 0.13707 0.13991 0.14325 0.14742 0.15022 0.15104 0.15676 0.15891 0.16556 0.16907 0.17155 0.17376 0.17703 0.18229 0.18422 0.18738 0.19161 0.19393 0.19630 0.19846 0.20438 0.20638 0.20813 0.21419 0.21613 0.22293 0.22878 0.23051 0.23368 0.23810 0.24023 0.24427 0.24484 0.24794 0.25098 0.25435 0.25650 0.26046 0.26599 0.26706 0.27198 0.27395 0.27432 0.27531 0.27691 0.28261 0.28330 0.28570 0.28805 0.29260 0.29376 0.29880 0.30325 0.30386 0.30642 0.31559 0.31910 0.32579 0.33145 0.33772 0.34290 0.34529 0.35530 0.35879 0.36461 0.36883 0.37906 0.38263 0.39073 0.39574 0.40435 0.41826 0.42408 0.43565 0.44229 0.45895 0.46956 0.47665 0.48193 0.48875 0.49719 0.50514 0.51527 0.51613 0.52230 0.52570 0.53130 0.54374 0.54747 0.54927 0.55430 0.55598 0.56551 0.57163 0.57804 0.58050 0.58306 0.58557 0.59827 0.60013 0.60253 0.61149 0.61541 0.62124 0.63653 0.63816 0.64435 0.65268 0.65787 0.66707 0.67415 0.67478 0.67782 0.68525 0.69132 0.69678 0.70106 0.71959 0.72364 0.73419 0.75611 0.77813 0.83343 0.93755 0.94581 0.95873 0.96730 0.97770 0.98383 0.98683 0.99348 0.99515 1.00015 1.00246 1.00624 1.01332 1.02123 1.02330 1.02955 1.03034 1.03736 1.04153 1.04855 1.04976 1.06414 1.06582 1.06911 1.07796 1.08151 1.08711 1.09447 1.09949 1.10231 1.10920 1.11605 1.11869 1.12749 1.13072 1.14017 1.14362 1.14676 1.16213 1.16484 1.16992 1.18416 1.19850 1.21861 1.22626 1.23067 1.24598 1.26128 1.27174 1.27556 1.28204 1.28744 1.29166 1.30524 1.31217 1.31441 1.31980 1.32211 1.33354 1.33513 1.34057 1.34729 1.34831 1.35227 1.36103 1.36356 1.37011 1.37827 1.38202 1.38897 1.39836 1.40312 1.41052 1.41794 1.41969 1.42372 1.43321 1.44053 1.44644 1.44935 1.45365 1.46117 1.46784 1.47132 1.47487 1.47945 1.48993 1.49643 1.50239 1.50951 1.51690 1.51970 1.53299 1.53561 1.54326 1.55394 1.56092 1.57701 1.58670 1.58737 1.59979 1.60872 1.60949 1.62190 1.62759 1.63488 1.64043 1.65413 1.66185 1.67390 1.68512 1.69147 1.69648 1.70691 1.71554 1.72444 1.73384 1.74550 1.75236 1.75565 1.75653 1.77431 1.77764 1.79540 1.80225 1.80992 1.81436 1.83812 1.84321 1.86109 1.87155 1.93232 2.02886 2.03354 2.04100 2.05982 2.08778 2.11131 2.11370 2.12786 2.16266 2.19206 2.19813 2.21815 2.23431 2.25292 2.25858 2.28009 2.29720 2.30711 2.31455 2.31854 2.33389 2.34783 2.35362 2.37041 2.38852 2.39461 2.41260 2.41356 2.42090 2.43843 2.44333 2.46253 2.49670 2.52238 2.57379 2.60250 2.60325 2.61932 2.64247 2.66200 2.69431 2.69888 2.70695 2.71519 2.72166 2.73177 2.74069 2.74980 2.75119 2.75776 2.77251 2.78192 2.78518 2.78896 2.80968 2.81222 2.82118 2.82764 2.84186 2.85310 2.87142 2.88551 2.88897 2.97736 3.07198 3.07834 3.08005 3.08138 3.09674 3.09776 3.10113 3.10561 3.11179 3.11523 3.11794 3.12707 3.13076 3.13520 3.14172 3.14331 3.15389 3.15469 3.15897 3.16117 3.16635 3.17195 3.17505 3.17950 3.18179 3.18661 3.19907 3.20628 3.21569 3.23402 3.28720 3.29935 3.30546 3.31536 3.32294 3.32982 3.33571 3.34448 3.35023 3.35500 3.36205 3.37250 3.39228 3.39771 3.40575 3.57961 3.69489 3.70050 3.71291 3.71845 3.72155 3.72762 3.73653 3.74069 3.75144 3.76341 3.77129 3.78336 3.80109 3.80672 3.81590 3.82586 3.83058 3.84068 3.84739 3.87229 3.89146 3.90970 3.91280 3.91736 3.91891 3.93672 3.94069 3.94245 3.94684 3.94967 3.95688 3.96344 3.96483 3.96783 3.98041 3.98640 4.00536 4.00945 4.10124 4.20800 4.23379 4.40870 4.65023 4.67396 5.00998 5.01764 5.02560 5.02919 5.04091 5.04689 5.05663 5.06024 5.06343 5.07376 5.11243 5.13280 5.18905 5.20801 5.26353 5.35245 5.37101 5.37959 5.39039 5.39918 5.40684 5.42986 5.43503 5.43820 5.44862 5.45363 5.48221 5.52527 5.53478 5.54484 5.65235 5.66378 5.66772 5.68194 5.68937 5.69405 5.70052 5.70683 5.71252 5.71942 5.72169 5.74410 5.75774 5.78717 5.82210 6.35016 6.36990 6.43496 6.43802 6.45863 6.47999 6.51383 6.65518 6.70088 14.59496 49.88161 49.89515 49.89722 49.90618 49.91575 49.92086 49.92860 49.93298 49.93665 49.94051 49.95197 49.96912 49.97858 49.99012 49.99646 66.84919 66.86491 66.87542 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.159791 -0.476279 -0.453495 -0.502663 -1.059451 0.372552 0.415440 -0.778956 0.333989 -0.858684 0.418544 0.434348 0.383889 -0.804756 0.410609 -0.738325 0.321655 -0.799856 0.408340 0.417048 -0.683208 0.300730 0.363149 -0.815145 0.434217 0.373366 -0.665644 0.391085 0.283580 -0.840782 0.426879 0.427239 -0.762358 0.415806 0.322826 -0.681449 0.340470 0.332111 -0.729961 0.397725 0.312045 -0.701792 0.391846 0.302608 -0.715807 0.401702 0.458382 0.316643 -1.00000 Mulliken charges with hydrogens summed into heavy atoms: 1 1 2 3 4 5 8 10 14 16 18 21 24 27 30 33 36 39 42 45 B F F F O O O O O O O O O O O O O O O 1.159791 -0.476279 -0.453495 -0.502663 -0.601069 -0.010618 -0.056251 -0.021596 -0.001231 0.025532 -0.019329 -0.007562 0.009021 0.013336 -0.023726 -0.008869 -0.020191 -0.007339 0.002538 -1.00000 2.08727991e+00 1.24946349e-01 1.04368848e+00 1.92319667e+02 -5.79500518e-01 1.87495931e+02 6.63829033e-01 1.02213837e+00 1.86969018e+02 -5.9325 -0.0011 -0.0008 -0.0007 5.6826 12.1342 22.7371 28.1610 34.7484 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 22.6034 27.6156 34.4120 38.5118 41.4200 44.0551 46.7442 58.4585 62.0986 63.0248 65.8360 66.7159 77.0983 81.4981 87.9960 94.9530 97.5233 104.0012 112.8608 123.5754 128.5126 134.3647 135.5645 146.5815 153.2819 154.6527 163.9090 169.9756 171.8360 192.5640 202.6821 204.4246 209.2319 217.8610 224.0820 225.9794 227.0108 230.8917 240.6886 248.2018 254.7673 257.9774 277.4272 279.2621 291.8479 330.1774 341.8366 355.2594 362.5261 385.5359 404.2872 416.6993 432.4568 446.8167 471.5852 476.6992 488.0977 493.1420 503.7548 509.4926 510.7889 519.4351 524.6876 529.1271 547.9806 557.5546 559.5783 587.0358 605.6619 624.1078 628.9872 642.6160 661.4935 674.8207 679.2524 683.8685 704.0876 721.0242 740.2212 746.5955 758.4841 766.3436 777.3213 800.0315 820.6028 825.2393 833.7153 847.1728 863.1271 874.2151 882.6969 904.0553 935.8466 1064.4715 1257.4218 1613.9697 1621.3293 1623.7665 1630.8232 1631.7831 1632.4147 1643.7110 1647.7813 1650.1693 1655.1836 1656.2803 1665.7513 1678.7463 1684.8849 3321.8180 3349.1488 3358.5676 3371.8211 3389.2180 3396.0447 3418.4037 3422.5311 3436.8652 3451.2774 3457.9595 3477.5576 3482.4518 3507.7321 3522.2979 3535.8447 3560.4587 3561.1825 3598.7440 3680.4830 3708.1094 3719.0370 3720.5267 3737.5520 3825.8826 3827.1093 3828.9071 3829.2741 3835.7589 6.1757 5.7370 6.8042 5.9447 7.0439 7.3278 6.0207 6.3692 7.6885 7.3048 6.7607 7.4403 7.5822 7.0532 6.7326 7.5220 6.1950 7.2666 6.7202 6.8459 6.8840 6.9028 6.7270 6.5980 7.2742 7.3295 7.3106 7.1383 6.3977 7.8822 7.0901 7.0370 6.2307 6.2841 6.4931 3.2119 5.9936 1.4299 6.3086 1.2027 4.8029 6.0605 4.4887 5.4055 1.1144 1.2626 1.1676 6.0372 4.9029 1.1618 1.0498 1.0601 1.0966 1.0941 1.2350 1.3914 1.4611 1.4794 1.1969 1.6310 1.3498 1.0624 2.5549 1.3040 1.0807 1.0378 1.2283 1.0458 1.0481 1.0447 1.0337 1.0512 1.0596 1.0464 1.0664 1.0471 1.0526 1.1588 3.3115 1.1690 1.0716 1.0536 1.0443 1.0501 1.0354 1.0432 1.0335 1.0436 1.0316 1.0415 8.8252 1.0741 4.8148 10.5323 1.2164 1.0757 1.0725 1.0743 1.0737 1.0706 1.0714 1.0755 1.0701 1.0749 1.0697 1.0672 1.0688 1.0682 1.0664 1.0635 1.0652 1.0630 1.0640 1.0651 1.0637 1.0650 1.0621 1.0651 1.0661 1.0594 1.0795 1.0647 1.0701 1.0588 1.0704 1.0697 1.0665 1.0690 1.0477 1.0675 1.0682 1.0683 1.0790 1.0638 1.0669 1.0667 1.0670 1.0654 0.0019 0.0026 0.0047 0.0052 0.0071 0.0084 0.0078 0.0128 0.0175 0.0171 0.0173 0.0195 0.0266 0.0276 0.0307 0.0400 0.0347 0.0463 0.0504 0.0616 0.0670 0.0734 0.0728 0.0835 0.1007 0.1033 0.1157 0.1215 0.1113 0.1722 0.1716 0.1733 0.1607 0.1757 0.1921 0.0966 0.1820 0.0449 0.2153 0.0437 0.1837 0.2376 0.2036 0.2484 0.0559 0.0811 0.0804 0.4489 0.3796 0.1017 0.1011 0.1085 0.1208 0.1287 0.1618 0.1863 0.2051 0.2120 0.1789 0.2494 0.2075 0.1689 0.4144 0.2151 0.1912 0.1901 0.2266 0.2123 0.2265 0.2398 0.2409 0.2558 0.2732 0.2808 0.2899 0.2885 0.3074 0.3549 1.0690 0.3839 0.3632 0.3646 0.3718 0.3960 0.4108 0.4186 0.4232 0.4413 0.4528 0.4690 4.0513 0.5172 2.4845 7.0314 1.1332 1.6510 1.6611 1.6689 1.6825 1.6796 1.6822 1.7120 1.7119 1.7245 1.7266 1.7249 1.7473 1.7736 1.7837 6.9139 7.0400 7.0646 7.1274 7.2087 7.2279 7.3324 7.3303 7.4127 7.4817 7.4636 7.6915 7.6073 7.7579 7.7396 7.8845 7.9899 7.9691 8.1567 8.3621 8.6478 8.7052 8.7128 8.8809 9.1747 9.2067 9.2135 9.2183 9.2354 1.3417 4.8755 1.4127 3.8994 4.9222 8.7308 2.1576 1.4265 3.6584 0.6760 3.6730 3.9184 0.9146 3.1469 16.6822 2.2696 24.2090 22.8396 2.8963 34.5171 38.1940 31.5680 9.1673 5.8436 51.3234 70.9851 33.4892 25.8099 45.1602 23.2605 85.0549 61.6560 24.8587 33.2783 61.7112 102.6119 64.5179 144.0374 60.1737 172.3269 46.9809 42.7263 55.9927 22.2129 154.6313 204.8364 47.9105 29.5019 27.1071 77.4787 108.8689 55.4046 14.4905 152.9843 74.7501 280.9470 42.2483 131.0404 83.2641 10.6620 96.3284 102.8866 230.1529 102.5221 294.8412 18.5330 38.6119 118.0926 40.9459 87.0737 84.5336 245.4219 233.7317 48.2072 601.3250 228.2611 79.5782 121.1615 89.4821 366.0371 423.6122 666.2243 76.4716 348.4600 89.3418 512.6036 88.5827 162.1077 85.7586 229.4331 590.5562 161.8307 504.1924 830.3370 180.6161 315.6842 115.3853 220.4549 105.0497 50.2088 108.3927 148.2832 155.1646 203.7287 106.5537 46.9290 249.9676 29.0752 38.3301 1638.9088 822.8267 1630.9287 1130.5312 2141.0163 1249.2338 202.2461 1064.3688 1444.7746 863.7109 99.8173 1215.9050 835.2899 869.5764 245.3070 357.6356 200.4959 1807.1122 556.3387 311.5026 532.3539 39.8428 589.1540 632.7265 239.7097 125.7418 99.0847 134.7397 133.8453 -0.05 0.02 -0.02 -0.09 0.04 -0.04 -0.07 0.00 -0.03 -0.04 0.06 -0.01 -0.02 -0.01 -0.01 -0.00 0.00 0.00 0.04 -0.07 -0.08 0.03 -0.15 0.15 0.02 -0.14 0.14 0.02 -0.01 0.04 0.02 -0.01 0.03 0.01 -0.11 0.19 0.01 0.00 0.06 0.03 -0.01 -0.02 0.02 0.03 -0.08 0.00 -0.02 -0.02 -0.07 0.00 -0.04 0.00 -0.02 -0.02 0.01 -0.01 -0.02 -0.00 -0.03 -0.00 0.01 0.03 0.02 -0.00 0.03 0.01 0.02 0.01 -0.00 0.04 -0.00 0.00 0.05 -0.01 -0.02 0.03 0.00 0.02 -0.02 0.14 0.08 -0.02 0.08 0.05 -0.05 0.10 0.04 0.02 -0.04 -0.02 -0.00 -0.02 -0.01 0.02 -0.07 0.02 0.04 0.02 0.24 0.03 0.08 0.18 0.04 0.04 0.21 -0.02 0.03 0.08 0.00 0.02 0.08 -0.05 0.03 0.05 0.11 -0.20 -0.21 0.07 -0.13 -0.12 0.21 -0.36 -0.15 -0.01 0.14 -0.23 0.00 0.07 -0.14 0.12 0.25 -0.26 -0.01 -0.01 0.02 0.00 0.01 0.02 -0.01 -0.01 0.01 0.02 -0.00 0.02 0.01 -0.03 0.04 -0.02 -0.02 0.03 0.02 -0.05 0.06 0.04 -0.02 0.02 0.00 -0.04 0.05 0.05 -0.03 0.02 -0.16 -0.02 0.02 -0.05 0.06 -0.10 -0.02 0.01 -0.05 -0.02 0.01 -0.00 -0.05 0.01 -0.00 0.01 0.11 -0.11 -0.00 0.03 -0.01 0.08 -0.05 0.00 0.06 0.02 -0.05 -0.14 0.01 -0.01 -0.11 -0.00 0.00 -0.03 -0.14 0.05 -0.02 -0.12 0.04 0.00 -0.11 0.04 0.05 -0.02 0.04 0.04 -0.01 0.04 0.03 -0.02 0.07 0.05 -0.05 -0.01 0.08 -0.06 -0.01 0.03 -0.02 -0.01 -0.04 -0.02 0.08 -0.03 -0.08 0.06 -0.06 0.07 0.19 0.01 -0.03 0.06 0.02 -0.04 0.07 -0.02 -0.02 0.00 0.13 0.24 -0.15 0.05 0.16 -0.09 0.11 0.40 -0.17 0.03 0.01 -0.03 0.02 0.01 -0.03 0.04 0.01 -0.02 -0.19 -0.05 0.06 -0.14 -0.09 0.05 -0.21 -0.02 0.04 0.05 0.15 -0.20 0.05 0.07 -0.08 0.19 0.28 -0.22 0.03 0.01 0.02 0.03 0.00 0.02 -0.00 -0.02 0.03 0.00 0.00 0.02 0.01 0.02 -0.06 0.13 -0.07 -0.08 -0.02 0.16 -0.19 -0.12 0.02 0.06 0.03 -0.02 -0.03 0.02 -0.02 0.02 -0.03 -0.04 -0.01 0.08 -0.00 0.02 0.06 0.02 -0.03 0.07 -0.09 0.03 0.04 -0.11 -0.03 0.03 -0.03 0.05 0.03 -0.02 0.08 0.03 -0.04 0.01 0.02 -0.00 -0.03 0.03 -0.12 -0.11 0.14 -0.09 -0.08 0.00 -0.06 0.00 0.02 -0.06 -0.00 0.01 -0.04 -0.02 -0.01 -0.01 -0.00 -0.04 0.00 0.01 -0.01 -0.03 -0.02 0.04 -0.04 0.00 0.04 -0.04 -0.01 0.04 -0.05 0.02 -0.02 0.04 0.01 -0.01 0.01 0.01 -0.06 0.01 -0.02 0.01 -0.01 -0.03 0.02 -0.02 -0.02 0.03 -0.01 -0.01 -0.07 -0.06 0.11 -0.04 -0.02 0.07 -0.06 -0.15 0.14 -0.05 0.07 0.14 0.03 0.04 0.15 -0.09 0.03 0.11 -0.17 0.17 0.24 -0.11 0.08 0.12 -0.36 0.42 0.13 0.00 0.07 -0.14 0.00 0.04 -0.10 0.09 0.12 -0.17 0.02 -0.05 0.03 0.01 -0.02 0.01 0.04 -0.06 -0.00 0.09 -0.04 0.02 -0.06 0.01 -0.02 -0.11 0.04 -0.04 -0.07 -0.03 -0.01 -0.03 0.04 -0.03 -0.04 -0.01 -0.02 -0.05 0.01 0.04 -0.03 0.03 -0.00 0.01 -0.14 0.14 0.03 -0.17 0.20 -0.02 -0.01 0.01 -0.04 -0.02 -0.00 0.09 -0.10 0.10 -0.02 0.01 0.01 -0.05 0.00 0.04 -0.05 -0.02 0.06 -0.03 -0.02 -0.01 -0.02 -0.01 -0.01 0.07 -0.01 -0.09 0.04 -0.02 -0.08 0.07 -0.01 -0.08 -0.00 0.03 -0.00 -0.01 0.03 -0.01 0.00 0.01 -0.02 0.04 -0.06 -0.03 -0.01 -0.03 0.00 0.03 -0.05 -0.02 0.07 0.04 -0.09 0.08 0.00 -0.11 0.04 -0.01 -0.15 -0.02 -0.04 -0.02 -0.04 -0.02 -0.03 -0.00 -0.06 0.03 0.39 0.07 -0.01 0.28 0.05 -0.02 0.34 0.32 -0.11 -0.02 0.04 0.02 0.01 0.03 0.04 -0.04 0.03 0.00 -0.06 0.15 0.06 -0.02 0.08 -0.01 -0.12 0.28 0.01 -0.07 -0.10 0.10 -0.06 -0.06 0.05 -0.12 -0.15 0.10 -0.01 -0.01 0.01 -0.00 0.01 0.00 -0.03 -0.02 0.00 0.02 -0.01 -0.00 0.02 0.01 -0.05 -0.12 0.10 -0.05 0.02 -0.12 0.05 0.14 0.05 -0.13 0.02 0.01 -0.05 -0.01 -0.09 0.14 0.10 0.07 0.06 -0.01 -0.08 -0.03 -0.02 -0.06 -0.02 -0.05 0.03 -0.07 0.03 0.03 -0.04 -0.03 -0.07 -0.00 -0.03 -0.06 -0.10 0.04 -0.11 0.12 0.02 -0.06 0.04 0.13 0.05 0.02 0.16 0.05 0.03 0.01 -0.02 -0.03 -0.00 -0.02 -0.03 -0.01 -0.04 -0.01 -0.06 0.13 0.16 -0.03 0.11 0.10 -0.03 0.12 0.08 -0.02 -0.10 0.06 0.02 -0.09 0.09 -0.02 -0.05 0.02 -0.02 0.05 -0.05 -0.01 0.04 -0.04 -0.04 0.02 -0.09 0.04 -0.02 -0.05 0.03 -0.01 -0.05 0.02 -0.02 -0.06 -0.10 -0.07 0.05 -0.06 -0.02 0.01 -0.09 -0.15 0.07 0.02 -0.14 -0.15 -0.14 -0.08 -0.15 0.10 -0.04 -0.14 0.04 0.11 0.19 0.05 0.06 0.09 -0.05 0.28 0.12 -0.01 0.07 -0.13 0.01 0.04 -0.11 0.11 0.11 -0.19 -0.07 0.06 0.16 -0.06 0.04 0.16 0.01 0.05 -0.07 -0.23 0.00 0.11 -0.05 -0.01 -0.04 -0.20 0.07 -0.11 -0.07 -0.11 -0.01 0.07 0.12 -0.06 0.00 -0.10 0.00 -0.08 0.07 -0.07 0.13 -0.08 0.00 -0.12 -0.02 -0.10 -0.12 -0.02 -0.09 0.07 -0.11 0.06 0.05 -0.11 0.04 -0.12 0.00 -0.08 0.08 -0.06 0.07 -0.10 0.09 -0.06 -0.09 0.07 -0.02 0.13 -0.13 -0.01 0.13 -0.07 -0.01 0.00 0.03 0.04 0.02 -0.02 0.05 -0.00 0.05 -0.00 0.22 0.03 -0.05 0.19 0.05 -0.07 0.17 0.01 0.05 -0.00 0.05 -0.04 -0.06 0.06 -0.06 0.01 -0.00 -0.01 0.02 0.01 0.11 0.01 0.02 0.08 0.05 0.09 0.20 0.04 -0.08 0.12 0.01 -0.08 0.07 -0.01 -0.07 0.05 -0.14 0.09 -0.05 -0.09 0.08 -0.03 -0.14 0.05 -0.07 0.08 0.06 0.10 0.20 0.01 0.17 0.01 0.03 0.06 0.07 0.04 0.12 0.05 0.05 0.10 -0.03 0.11 0.08 -0.07 0.03 0.06 -0.02 -0.02 0.10 -0.08 0.09 0.09 0.04 -0.11 -0.10 0.10 -0.01 -0.09 0.02 -0.10 0.03 0.24 -0.06 -0.08 -0.05 0.03 -0.05 -0.00 0.01 -0.03 -0.06 0.07 -0.08 -0.10 0.00 -0.03 -0.06 0.05 -0.06 0.08 -0.07 -0.11 0.15 0.04 0.05 -0.00 0.01 0.01 0.01 -0.01 0.02 -0.06 0.03 -0.03 0.03 0.03 -0.01 0.01 0.03 0.02 -0.09 -0.03 -0.02 0.08 -0.06 -0.12 0.09 -0.07 -0.10 0.17 0.05 0.03 0.18 0.04 0.03 -0.08 -0.00 -0.04 -0.08 0.00 -0.04 -0.08 0.00 -0.04 -0.03 -0.04 0.04 -0.01 -0.05 0.05 -0.02 -0.02 0.03 -0.04 0.02 -0.04 0.01 -0.01 -0.07 -0.05 0.03 -0.03 0.02 -0.17 0.27 -0.03 -0.11 0.13 0.18 -0.03 0.43 0.03 0.00 0.03 0.00 0.02 0.01 0.01 -0.01 0.02 0.08 0.11 -0.01 0.04 0.01 0.07 0.07 0.22 -0.03 -0.13 -0.08 -0.02 -0.21 -0.05 -0.07 -0.10 -0.05 -0.02 0.14 0.00 0.09 0.08 0.01 0.04 0.12 0.05 0.08 0.16 -0.06 0.02 0.15 -0.09 0.07 0.09 -0.01 0.08 -0.07 0.03 -0.01 -0.07 -0.04 0.01 -0.05 0.06 -0.07 -0.21 0.01 0.00 -0.03 -0.03 0.01 -0.06 -0.02 0.00 -0.02 -0.06 0.03 -0.00 -0.04 -0.02 -0.04 -0.03 0.00 0.10 -0.07 -0.03 -0.08 0.02 -0.05 -0.11 0.12 0.10 -0.10 0.10 0.06 -0.04 -0.04 0.00 -0.07 -0.04 -0.00 -0.12 0.10 0.10 -0.01 -0.03 -0.02 0.08 -0.08 -0.01 0.10 -0.03 0.00 -0.11 -0.05 -0.01 -0.14 -0.04 -0.02 0.17 0.01 -0.15 0.14 0.00 -0.14 0.14 -0.02 -0.13 -0.05 -0.04 -0.05 -0.02 -0.05 -0.02 -0.05 0.01 -0.01 0.10 -0.11 -0.09 0.08 -0.09 -0.07 0.07 -0.09 -0.07 0.19 0.11 0.10 0.16 0.11 -0.00 0.26 0.14 0.12 -0.08 0.11 0.08 -0.08 0.11 0.07 -0.09 0.10 0.08 -0.15 0.03 0.07 0.01 0.07 0.07 -0.15 -0.14 0.01 0.00 -0.06 -0.02 -0.04 -0.05 -0.04 0.01 -0.05 -0.02 -0.05 0.15 -0.11 0.02 0.08 -0.15 -0.05 0.23 -0.13 0.16 0.04 0.06 0.10 0.03 0.09 0.11 0.04 0.09 0.03 -0.02 0.00 -0.02 -0.03 -0.02 -0.03 -0.06 0.03 -0.00 -0.05 -0.03 -0.02 -0.07 -0.02 0.05 -0.10 0.02 -0.07 -0.04 -0.13 -0.11 -0.08 0.06 0.05 -0.08 -0.05 -0.02 -0.02 0.18 -0.01 0.11 -0.03 -0.02 -0.15 -0.17 -0.04 -0.11 -0.13 0.03 0.06 -0.12 0.00 0.06 -0.09 -0.05 -0.07 -0.09 -0.00 0.06 -0.09 -0.02 -0.04 0.18 -0.03 -0.05 0.16 -0.03 0.09 -0.00 -0.06 0.01 -0.00 0.06 0.17 0.01 0.08 0.12 0.01 -0.02 0.11 0.02 0.02 -0.10 0.08 0.00 -0.09 0.12 0.05 -0.10 0.03 -0.10 -0.03 0.14 -0.07 -0.02 0.17 -0.07 -0.01 0.07 0.11 0.10 0.13 0.09 0.15 0.09 0.18 0.12 0.15 0.11 -0.12 -0.03 0.09 -0.13 -0.06 0.07 -0.11 -0.09 -0.07 0.15 -0.00 -0.02 0.14 0.02 -0.07 0.11 -0.02 -0.02 0.14 -0.11 0.03 0.11 -0.07 -0.03 0.09 -0.07 0.03 0.11 -0.11 0.04 0.12 -0.06 0.09 0.03 -0.08 -0.09 -0.03 0.03 0.00 -0.07 0.04 -0.00 0.04 0.01 0.08 0.02 0.07 0.09 -0.01 0.08 0.07 -0.01 -0.06 -0.00 0.00 0.06 0.04 0.00 -0.01 -0.02 0.02 -0.06 0.06 -0.03 0.05 0.11 0.03 -0.05 0.01 -0.02 0.01 0.04 0.01 -0.05 -0.09 -0.07 -0.14 0.05 -0.04 -0.06 0.05 -0.05 -0.04 0.06 -0.08 0.10 0.02 -0.09 0.05 0.05 -0.01 -0.04 0.05 -0.04 0.12 0.08 0.03 -0.09 0.06 -0.04 -0.10 -0.12 -0.13 -0.11 -0.13 -0.06 -0.12 -0.03 0.22 0.07 -0.00 0.21 0.06 -0.05 0.21 0.07 -0.13 0.09 0.07 -0.10 0.08 0.04 -0.09 0.08 -0.01 -0.09 0.17 0.12 -0.07 0.12 0.02 -0.06 0.09 0.12 0.06 -0.09 0.10 0.03 0.03 0.09 0.16 -0.05 0.14 -0.02 -0.04 -0.12 -0.02 -0.03 -0.10 -0.02 -0.04 -0.11 0.04 0.01 -0.03 0.01 -0.04 0.02 0.04 0.04 -0.00 0.04 -0.13 0.14 -0.01 -0.10 0.12 0.04 -0.09 0.10 -0.11 0.12 -0.15 -0.11 0.16 -0.07 -0.15 0.04 -0.14 0.07 -0.12 -0.07 0.06 -0.13 -0.06 0.02 -0.11 -0.04 -0.06 -0.02 0.10 -0.08 -0.00 0.08 0.00 -0.04 0.02 -0.01 -0.02 0.10 -0.02 -0.06 -0.04 -0.03 -0.04 -0.01 -0.01 -0.09 -0.00 0.00 -0.09 -0.08 -0.03 -0.02 -0.06 0.13 0.04 0.12 0.07 -0.04 0.04 -0.07 0.06 0.10 -0.04 0.01 0.08 0.08 -0.04 -0.01 0.03 -0.04 -0.01 -0.04 0.08 0.08 0.08 0.01 -0.01 0.12 -0.01 0.15 0.12 -0.01 0.14 0.08 -0.05 0.02 0.09 -0.05 0.03 -0.12 0.02 -0.01 -0.12 0.04 -0.02 -0.12 0.01 0.02 -0.14 -0.00 -0.20 -0.15 0.00 -0.16 -0.14 0.00 -0.21 -0.08 0.01 0.11 -0.02 0.00 0.11 -0.06 0.03 0.06 -0.12 -0.02 0.05 -0.13 -0.01 0.02 -0.09 -0.05 0.01 -0.17 0.11 -0.10 -0.15 0.10 -0.08 -0.13 0.10 -0.05 0.04 0.07 0.03 -0.03 0.02 0.06 0.03 0.18 0.02 0.15 0.13 0.00 0.23 0.09 0.03 0.09 0.08 -0.04 0.07 -0.01 0.08 0.01 0.00 0.04 0.04 0.03 0.06 0.04 -0.02 -0.02 -0.04 0.01 -0.04 0.06 -0.07 -0.06 0.21 0.04 0.01 0.09 0.07 -0.06 -0.03 -0.05 -0.05 0.27 0.01 -0.04 0.02 -0.07 -0.07 0.01 -0.04 -0.02 0.00 -0.11 -0.08 0.02 -0.07 -0.07 0.06 -0.05 -0.10 -0.09 0.16 0.02 -0.05 0.02 0.00 -0.01 -0.02 -0.00 -0.01 -0.03 -0.01 0.20 0.09 -0.02 0.18 0.09 0.02 -0.03 0.01 0.03 0.14 0.07 0.03 -0.07 0.24 -0.02 -0.08 0.17 -0.01 -0.03 0.10 -0.01 -0.03 0.05 -0.01 -0.01 -0.16 -0.06 -0.00 -0.13 -0.07 0.09 -0.08 -0.09 -0.15 0.01 0.11 -0.12 -0.01 0.11 -0.12 0.03 0.03 0.27 0.09 -0.09 0.17 0.13 -0.04 0.22 0.10 -0.03 -0.02 -0.01 0.13 -0.03 -0.09 0.06 -0.03 0.02 0.16 -0.02 0.01 -0.04 -0.01 -0.02 -0.06 -0.01 0.04 -0.05 -0.05 0.05 0.06 -0.03 0.05 0.08 -0.05 0.03 0.06 0.04 -0.05 0.04 -0.00 -0.03 -0.00 0.04 -0.04 0.02 -0.08 -0.07 0.03 -0.06 -0.09 0.00 -0.09 -0.02 0.02 -0.10 -0.04 0.11 -0.08 -0.03 0.07 -0.21 -0.07 0.16 -0.06 0.08 0.10 -0.09 0.06 0.09 0.08 0.02 -0.11 -0.04 0.08 0.10 -0.03 -0.10 -0.04 -0.02 -0.15 -0.14 -0.00 -0.04 -0.04 -0.03 -0.07 -0.02 -0.07 -0.16 0.02 0.08 0.09 -0.02 0.08 0.02 -0.10 -0.05 0.10 0.13 -0.02 0.05 0.07 -0.04 0.02 -0.01 -0.01 0.01 -0.05 -0.01 0.02 0.04 -0.04 0.02 -0.02 0.08 0.14 -0.03 0.08 0.13 -0.02 0.08 0.01 -0.11 0.08 -0.01 -0.11 -0.04 0.10 0.03 -0.07 0.02 0.07 -0.04 0.12 -0.00 0.02 -0.10 0.21 0.03 -0.10 0.21 0.01 -0.08 0.24 -0.04 0.14 -0.02 -0.02 0.13 -0.04 -0.04 0.12 -0.00 -0.05 0.01 -0.18 -0.03 0.04 -0.11 -0.07 -0.00 -0.20 -0.05 -0.06 0.27 -0.06 -0.08 0.21 -0.04 -0.03 0.24 0.06 -0.08 -0.04 0.03 -0.06 -0.07 0.05 -0.03 -0.07 0.01 0.04 -0.06 0.00 0.04 -0.05 0.02 0.03 -0.05 0.05 0.03 -0.04 0.02 0.07 0.03 0.00 -0.04 -0.03 0.10 0.09 -0.03 0.00 0.06 0.06 0.13 0.11 -0.03 0.02 0.06 0.11 0.01 0.01 0.11 -0.09 -0.09 -0.05 -0.06 0.05 0.11 0.03 -0.03 0.07 0.03 -0.07 -0.02 0.03 0.02 0.04 0.04 0.05 0.14 0.03 -0.12 0.14 -0.05 0.08 -0.03 0.06 -0.01 -0.01 0.01 0.03 0.02 0.02 -0.01 -0.01 -0.09 -0.03 -0.07 -0.09 -0.03 -0.09 0.01 0.04 0.02 -0.05 -0.00 -0.10 -0.00 0.04 -0.06 -0.03 -0.02 -0.10 0.07 -0.04 -0.03 0.10 -0.04 -0.02 0.11 -0.02 0.08 0.12 -0.06 0.09 0.09 -0.01 0.03 -0.10 0.20 0.01 -0.16 0.23 -0.08 -0.13 0.10 0.03 0.01 -0.03 -0.15 -0.01 -0.02 -0.13 0.01 -0.04 -0.13 0.12 -0.05 0.10 0.12 -0.04 0.11 0.12 -0.03 0.12 -0.19 -0.07 -0.05 -0.14 -0.10 -0.02 -0.15 -0.04 -0.04 -0.01 -0.01 0.01 0.04 -0.03 0.04 -0.01 -0.06 -0.00 0.02 0.24 -0.16 0.14 0.18 0.03 0.05 0.21 -0.09 0.06 -0.03 0.04 0.08 -0.02 0.07 0.04 -0.05 0.04 -0.06 -0.13 -0.11 -0.09 -0.15 -0.06 -0.07 -0.09 -0.09 -0.10 0.04 0.02 -0.09 0.15 -0.01 0.01 -0.06 0.09 0.07 0.04 -0.02 0.02 -0.02 -0.01 -0.04 -0.00 -0.07 -0.06 -0.03 -0.12 0.01 0.12 0.10 0.13 -0.14 0.04 0.05 -0.18 -0.06 -0.01 0.07 -0.01 -0.08 0.04 0.06 -0.06 0.01 0.04 0.13 0.09 -0.10 0.13 0.11 -0.03 -0.06 0.04 0.05 0.05 0.03 -0.05 0.03 -0.12 -0.07 0.05 -0.09 -0.04 0.00 0.16 -0.03 -0.00 0.09 -0.02 0.05 0.02 0.21 0.09 -0.01 0.20 0.02 0.01 0.18 0.02 0.07 -0.11 -0.00 0.08 -0.14 -0.02 0.05 -0.04 0.01 0.03 0.12 0.07 -0.00 0.08 0.04 0.03 0.06 -0.01 0.12 -0.06 0.03 0.10 0.05 -0.11 -0.03 -0.23 -0.10 0.03 0.00 -0.06 -0.01 0.01 -0.08 0.05 -0.00 0.01 0.05 0.01 0.01 0.04 0.02 -0.00 0.10 -0.03 -0.12 -0.17 -0.02 -0.27 -0.10 -0.10 -0.03 -0.10 0.02 -0.06 -0.08 0.04 -0.02 -0.05 0.14 -0.07 -0.18 0.06 0.08 -0.09 0.04 -0.01 -0.03 0.01 -0.05 -0.18 0.08 0.03 -0.07 -0.02 -0.02 -0.04 -0.05 0.15 -0.05 0.01 -0.09 -0.14 -0.11 -0.01 -0.01 -0.02 -0.02 -0.06 -0.15 0.07 0.07 0.06 0.04 0.01 -0.05 -0.12 -0.06 0.06 -0.07 -0.05 0.11 0.06 0.18 -0.09 0.10 0.10 -0.01 0.12 0.06 -0.08 -0.10 0.19 0.17 -0.01 0.17 0.10 0.09 0.07 -0.02 -0.05 0.15 0.12 -0.07 -0.03 0.11 -0.08 -0.02 0.08 0.07 0.25 -0.09 0.05 0.20 -0.09 0.03 -0.01 -0.06 -0.02 -0.01 -0.03 0.05 -0.01 -0.02 0.03 -0.07 -0.13 -0.01 -0.05 -0.12 -0.00 -0.10 -0.06 0.09 -0.04 0.09 0.07 -0.02 0.13 0.05 0.01 0.10 0.06 -0.10 0.08 0.04 -0.08 0.03 0.11 -0.01 0.18 -0.12 -0.11 0.03 -0.12 -0.12 0.01 -0.07 -0.08 0.06 -0.01 -0.03 -0.02 0.02 -0.05 0.01 0.01 -0.11 0.03 0.01 -0.09 0.10 -0.03 -0.07 -0.02 -0.01 -0.11 0.10 0.01 0.06 -0.04 0.05 0.04 -0.04 -0.02 0.08 -0.05 -0.18 -0.03 -0.11 -0.15 -0.10 -0.03 0.01 0.08 -0.17 0.09 -0.05 -0.03 0.07 -0.06 -0.04 -0.13 -0.03 0.02 0.04 -0.06 -0.04 -0.01 0.01 0.01 -0.01 -0.02 -0.05 0.04 0.05 0.06 0.01 0.00 -0.02 -0.08 0.00 0.04 0.12 0.02 -0.04 0.03 -0.03 -0.04 0.08 -0.04 -0.15 0.07 -0.03 -0.12 -0.16 0.02 0.11 -0.08 -0.00 0.03 0.04 0.03 -0.06 -0.08 0.01 0.04 0.13 0.02 -0.04 0.12 -0.04 -0.03 0.05 -0.02 -0.07 0.08 0.02 -0.06 -0.02 -0.06 0.00 -0.03 -0.07 0.01 -0.03 -0.05 -0.01 -0.02 -0.06 0.03 -0.04 -0.06 0.05 -0.01 -0.07 -0.00 0.01 -0.02 -0.10 0.03 -0.02 -0.09 -0.02 0.01 -0.07 -0.10 0.27 -0.05 -0.08 0.18 -0.06 -0.18 0.01 -0.36 0.01 -0.10 -0.04 0.02 -0.09 -0.03 0.00 -0.08 -0.07 -0.07 0.17 0.08 -0.08 0.18 0.08 -0.05 0.13 0.15 0.02 -0.01 0.04 -0.04 0.01 -0.02 0.02 0.00 0.03 -0.01 -0.06 0.05 -0.01 -0.06 0.04 -0.06 -0.03 0.03 0.09 -0.21 0.09 0.01 -0.13 0.01 -0.16 -0.33 0.18 0.08 0.07 0.03 0.04 0.00 0.02 -0.09 0.01 0.02 -0.05 0.05 0.02 0.04 0.00 -0.02 -0.05 0.05 -0.04 0.06 -0.07 0.06 0.11 0.01 -0.08 0.02 0.01 -0.02 -0.03 -0.08 -0.10 0.02 0.05 -0.03 0.05 0.07 0.00 0.05 0.05 -0.02 0.08 0.04 0.01 0.06 0.04 -0.01 0.04 0.06 0.00 -0.01 0.10 0.10 -0.02 -0.17 -0.09 -0.02 -0.13 -0.11 0.04 0.09 -0.05 0.05 0.07 -0.04 0.00 -0.02 0.01 -0.01 0.01 0.01 0.01 -0.03 0.04 -0.14 -0.23 0.07 -0.05 -0.28 0.20 -0.08 -0.09 -0.01 0.03 -0.02 0.13 0.03 -0.06 0.04 0.03 -0.04 0.15 -0.01 0.04 -0.02 -0.00 0.03 -0.02 -0.02 -0.00 -0.07 0.03 0.05 -0.01 0.05 0.04 0.01 0.04 0.05 -0.01 -0.00 0.01 0.01 -0.00 0.01 0.01 0.01 -0.02 0.04 -0.08 0.34 0.04 0.25 0.19 0.24 -0.20 0.18 0.05 -0.01 -0.01 0.01 0.00 -0.02 0.01 -0.03 0.01 0.00 0.06 -0.01 0.03 0.06 0.01 -0.00 -0.03 -0.05 0.07 -0.21 -0.17 -0.07 -0.12 -0.18 -0.02 0.02 0.01 -0.03 0.08 -0.01 0.10 -0.02 -0.06 -0.04 0.08 -0.10 0.03 0.01 -0.01 -0.03 -0.05 -0.13 -0.04 -0.06 0.00 -0.06 -0.01 -0.06 -0.05 -0.03 0.07 0.08 0.00 0.05 0.02 0.02 0.01 -0.02 0.06 0.03 0.06 0.03 0.04 0.09 0.00 0.05 0.02 0.04 0.03 0.08 0.03 -0.13 -0.07 0.01 -0.12 -0.11 -0.05 0.08 0.12 -0.10 0.01 0.11 -0.08 0.00 -0.14 -0.12 0.01 -0.12 -0.05 -0.01 -0.09 0.19 0.31 0.05 0.13 0.35 -0.22 0.12 0.15 0.14 0.03 0.00 0.09 0.05 -0.03 0.03 0.02 0.01 0.12 -0.10 0.05 -0.03 -0.12 0.04 -0.09 -0.07 -0.01 -0.11 -0.04 -0.06 0.07 -0.07 -0.07 0.01 -0.04 -0.05 0.05 -0.02 0.06 0.03 -0.05 0.05 0.03 -0.02 0.07 0.06 0.10 0.05 0.01 0.25 -0.02 0.11 0.04 -0.03 0.02 0.03 0.06 -0.04 0.01 0.05 -0.09 0.11 0.08 -0.02 0.04 -0.09 -0.01 -0.00 -0.10 0.01 -0.06 -0.10 0.04 -0.17 -0.11 -0.02 -0.03 0.03 0.01 -0.06 -0.03 -0.04 0.11 -0.03 0.02 -0.05 0.05 -0.02 -0.09 0.08 -0.04 -0.04 0.09 -0.03 -0.03 0.08 -0.04 -0.06 0.02 -0.00 0.01 -0.02 0.02 -0.08 -0.06 0.18 0.21 0.20 -0.02 0.24 0.13 -0.17 0.12 -0.08 -0.13 -0.02 -0.04 0.04 0.17 0.15 -0.02 0.04 -0.10 -0.06 0.03 0.04 -0.01 0.02 -0.01 -0.02 -0.14 -0.10 0.27 -0.22 -0.13 0.25 0.01 0.00 -0.02 -0.02 0.01 -0.01 0.04 0.01 -0.00 -0.01 -0.12 0.03 -0.02 -0.12 0.08 -0.01 -0.11 0.04 0.07 0.05 0.06 0.06 0.05 0.04 0.08 0.04 0.06 0.01 0.02 0.00 0.01 0.01 -0.01 -0.01 -0.04 -0.07 -0.07 -0.12 0.07 -0.08 -0.15 0.01 -0.01 -0.06 0.07 0.00 0.00 0.02 0.01 -0.01 0.04 0.03 -0.11 0.14 -0.01 -0.03 -0.15 -0.02 -0.03 -0.07 0.03 0.00 -0.12 0.04 0.00 0.03 0.01 0.01 0.00 0.16 -0.03 0.06 -0.07 -0.12 -0.09 -0.11 -0.15 -0.04 -0.05 -0.09 -0.08 0.07 -0.05 0.05 0.04 -0.08 0.04 -0.06 -0.05 0.05 0.02 -0.07 0.04 0.03 -0.03 0.00 -0.01 -0.00 0.02 0.03 -0.08 0.04 0.05 -0.01 -0.00 0.03 -0.02 -0.01 0.03 0.10 0.06 -0.00 0.01 0.00 0.06 0.08 0.00 0.08 0.04 -0.05 0.16 -0.01 -0.17 0.06 0.01 -0.11 0.06 0.07 -0.00 0.06 0.05 -0.09 0.05 -0.08 0.10 0.04 -0.08 0.06 -0.01 -0.01 0.01 -0.02 -0.03 0.01 -0.01 0.02 -0.02 -0.01 -0.01 -0.02 -0.05 0.01 -0.04 0.06 -0.01 -0.00 0.01 0.00 0.07 0.01 -0.02 0.09 -0.10 -0.08 -0.11 -0.05 -0.06 -0.05 -0.06 -0.06 -0.20 -0.03 -0.00 -0.00 -0.03 0.01 -0.01 -0.02 -0.04 -0.04 -0.05 -0.08 0.08 -0.06 -0.12 0.02 -0.02 -0.03 0.06 -0.00 0.00 0.01 -0.01 -0.01 0.02 0.01 -0.02 0.06 -0.12 0.01 0.29 -0.27 0.09 0.04 -0.19 0.05 0.17 0.02 0.04 -0.03 0.02 0.05 -0.04 0.05 0.03 -0.02 -0.04 -0.06 -0.05 -0.07 -0.09 -0.00 0.04 -0.02 -0.08 -0.09 0.32 -0.15 -0.08 0.28 -0.13 0.01 0.09 -0.08 -0.16 0.28 -0.17 0.00 -0.05 -0.09 -0.03 -0.02 -0.07 -0.05 -0.05 -0.17 -0.01 0.01 -0.05 0.07 -0.09 -0.08 -0.01 0.04 -0.05 -0.09 0.08 0.17 0.11 0.08 -0.02 0.12 0.06 -0.10 -0.16 0.05 0.12 -0.09 0.04 0.10 0.08 0.05 -0.02 0.01 0.01 -0.03 -0.03 -0.01 -0.02 -0.02 -0.00 -0.00 -0.11 0.12 0.21 -0.16 0.00 0.21 0.04 0.03 0.11 0.13 -0.04 0.09 -0.06 0.00 0.03 -0.07 0.00 0.05 -0.04 -0.01 0.07 -0.04 0.03 -0.00 -0.19 -0.09 -0.15 -0.17 -0.08 -0.13 -0.18 -0.10 -0.16 0.10 0.02 -0.00 0.11 0.04 0.06 0.07 0.01 -0.00 0.04 0.05 -0.05 0.07 0.02 -0.04 0.06 0.07 -0.05 0.04 -0.05 -0.00 0.07 -0.04 -0.01 0.05 -0.12 0.02 0.21 0.00 0.14 0.21 0.01 0.11 0.14 0.01 0.04 -0.01 -0.06 0.06 -0.00 -0.05 0.11 0.14 -0.20 0.12 0.03 0.05 0.01 0.05 0.06 -0.00 0.05 0.04 0.00 -0.02 0.01 -0.00 -0.02 0.04 -0.02 0.11 -0.07 -0.07 0.09 0.03 -0.00 -0.03 0.07 -0.02 0.03 0.05 0.03 -0.02 0.10 -0.02 -0.07 -0.04 -0.08 -0.07 0.13 -0.06 -0.00 0.11 0.01 -0.01 -0.07 -0.04 -0.12 -0.04 0.05 -0.13 -0.03 0.07 0.06 0.01 0.04 0.04 0.01 0.01 -0.10 -0.05 0.03 0.13 0.03 -0.02 0.03 -0.06 0.03 0.01 -0.08 -0.02 0.02 -0.05 -0.08 0.07 0.03 -0.08 0.07 0.01 0.12 0.07 0.04 0.12 0.06 -0.00 0.14 -0.01 -0.10 0.01 -0.02 -0.09 0.04 -0.03 -0.09 0.06 0.01 0.03 0.11 0.04 0.01 0.07 0.05 0.01 0.06 0.16 0.08 -0.00 0.18 0.06 0.05 0.10 0.03 -0.05 -0.06 -0.07 0.09 -0.09 -0.06 0.05 -0.07 -0.07 0.08 -0.01 -0.01 -0.04 0.07 0.01 -0.03 -0.03 -0.02 -0.15 0.27 -0.07 -0.07 0.24 -0.06 -0.08 0.26 -0.06 -0.10 -0.05 -0.10 0.07 -0.03 -0.10 0.12 -0.13 -0.10 0.06 -0.05 -0.07 -0.05 -0.06 -0.11 -0.01 0.00 -0.02 -0.06 -0.18 0.15 -0.15 -0.11 0.11 -0.10 -0.05 0.10 -0.01 -0.02 0.26 -0.02 0.03 0.03 0.05 0.02 0.02 -0.05 -0.01 0.09 -0.04 0.03 0.15 0.13 0.07 -0.06 0.10 -0.02 -0.04 -0.03 0.05 0.09 -0.01 -0.09 -0.05 0.04 -0.10 -0.04 0.08 0.06 -0.00 -0.01 0.03 0.00 0.02 -0.08 -0.04 0.05 0.12 -0.01 -0.07 -0.01 -0.13 -0.01 -0.01 -0.08 -0.03 0.01 0.05 0.04 -0.05 0.01 0.03 -0.05 0.03 -0.04 -0.04 -0.00 -0.04 -0.06 0.05 -0.07 -0.07 -0.13 0.07 -0.04 -0.15 0.19 -0.04 -0.06 0.03 0.06 -0.07 -0.12 0.04 -0.06 -0.11 0.03 -0.07 -0.08 -0.24 -0.10 -0.01 -0.25 -0.08 -0.00 -0.21 -0.08 0.01 0.00 0.00 0.01 0.02 0.02 0.05 -0.02 -0.02 0.00 -0.02 0.06 0.02 -0.15 0.02 0.03 -0.04 0.25 0.01 0.25 -0.06 -0.03 0.18 -0.03 -0.01 0.30 -0.00 -0.04 0.05 0.17 -0.13 0.05 0.19 -0.13 0.11 0.13 -0.11 -0.03 -0.02 0.01 -0.02 -0.01 -0.02 -0.06 -0.04 0.02 -0.03 0.01 -0.03 -0.03 0.00 -0.03 0.07 -0.03 0.09 0.06 0.03 -0.00 -0.09 -0.06 0.06 -0.17 0.00 0.14 -0.18 -0.14 0.00 -0.14 -0.03 0.12 0.03 -0.05 0.00 -0.00 0.03 0.02 0.08 -0.05 -0.17 0.26 0.20 -0.05 0.30 0.12 -0.20 -0.01 0.02 0.08 0.05 -0.00 -0.02 0.22 0.16 -0.04 0.06 0.03 0.03 0.01 -0.04 0.03 0.00 -0.02 0.01 0.10 -0.06 -0.20 0.13 0.06 -0.20 -0.00 0.02 0.02 0.01 0.01 0.02 0.01 0.03 0.02 0.03 0.02 -0.01 0.02 0.03 -0.02 0.03 0.01 -0.01 0.07 0.02 0.03 0.06 0.02 0.02 0.06 0.02 0.04 -0.05 -0.04 -0.00 -0.05 -0.03 0.02 -0.06 -0.04 -0.00 0.08 0.05 -0.09 0.12 0.02 -0.07 0.12 0.08 -0.08 0.04 -0.02 0.04 -0.00 -0.03 0.05 0.08 -0.14 0.23 0.10 -0.04 -0.09 0.08 -0.03 -0.08 0.14 -0.04 -0.04 -0.01 0.03 -0.04 -0.01 0.04 -0.02 -0.19 0.09 -0.10 0.00 0.03 0.03 0.04 0.06 -0.02 0.00 -0.00 0.01 -0.09 0.06 -0.06 -0.03 0.05 -0.03 0.08 0.05 0.00 -0.04 0.09 -0.01 0.02 0.04 -0.01 0.03 0.10 0.15 -0.03 -0.06 -0.03 -0.01 -0.04 -0.03 0.08 0.12 -0.09 -0.04 -0.11 -0.07 0.04 0.04 -0.06 -0.11 0.18 0.22 -0.05 0.06 0.08 -0.04 -0.01 0.00 0.04 -0.03 -0.05 -0.07 0.12 0.15 -0.02 -0.02 -0.02 -0.02 -0.02 -0.10 -0.03 -0.10 -0.10 0.07 0.06 -0.11 0.13 0.09 -0.10 0.01 0.01 0.04 0.07 0.01 0.01 -0.03 0.01 0.00 0.10 -0.03 0.17 0.11 -0.03 0.11 0.13 -0.06 0.11 -0.06 -0.04 -0.10 -0.07 -0.04 -0.10 -0.07 -0.06 -0.07 0.01 -0.00 0.01 0.02 -0.01 0.05 -0.05 -0.11 -0.12 0.04 -0.01 -0.06 0.04 0.01 -0.02 0.04 -0.06 -0.03 -0.05 0.05 -0.05 -0.01 -0.01 0.01 -0.06 0.08 -0.12 -0.00 0.02 0.06 -0.01 0.02 0.02 -0.04 0.02 0.02 -0.04 0.00 -0.03 -0.03 0.01 -0.00 -0.08 -0.01 -0.03 -0.16 -0.20 -0.14 -0.13 -0.19 -0.18 -0.15 -0.20 -0.15 0.19 -0.09 0.11 0.18 -0.14 0.12 0.11 0.06 -0.04 -0.00 -0.13 0.09 0.04 -0.02 -0.07 0.04 0.00 -0.03 0.02 -0.04 -0.09 0.04 -0.02 -0.07 0.06 -0.00 -0.08 0.10 0.15 0.21 -0.02 -0.05 0.05 -0.06 0.03 0.08 -0.05 -0.00 0.04 -0.15 0.02 0.18 -0.08 0.00 0.09 -0.05 0.02 0.06 -0.10 0.00 0.14 0.15 -0.01 0.21 0.12 -0.02 0.11 -0.05 -0.13 0.09 -0.08 -0.08 0.07 0.02 0.11 0.19 0.09 0.07 0.17 0.00 0.16 0.10 0.10 -0.04 -0.08 0.10 -0.04 -0.04 0.07 -0.02 -0.02 0.22 0.03 -0.10 0.19 0.07 -0.05 0.15 0.08 -0.03 -0.09 -0.05 0.00 -0.07 -0.02 0.11 -0.15 -0.11 -0.07 0.05 0.03 -0.05 0.05 0.03 -0.03 0.04 0.00 -0.04 -0.02 0.03 -0.01 -0.08 -0.02 0.02 -0.03 0.15 -0.03 -0.18 0.03 -0.10 -0.06 -0.02 -0.00 -0.16 -0.03 -0.02 0.03 0.06 -0.03 0.01 0.12 0.07 0.12 -0.12 0.03 -0.07 -0.05 -0.01 -0.05 -0.03 -0.06 0.03 -0.06 -0.08 -0.16 0.01 -0.05 -0.07 0.00 0.01 0.07 0.01 -0.09 -0.07 0.07 0.03 -0.04 0.04 -0.02 -0.01 0.06 0.09 -0.01 0.02 0.04 -0.06 -0.09 -0.11 -0.07 0.12 -0.07 0.01 -0.11 -0.02 0.05 0.09 -0.02 0.07 -0.08 -0.16 0.04 -0.01 -0.07 0.08 -0.06 -0.07 0.07 -0.06 -0.03 0.05 -0.06 -0.13 0.03 -0.05 -0.02 -0.02 -0.12 0.01 -0.00 -0.01 0.03 0.07 0.09 -0.05 0.09 0.07 -0.04 0.01 0.12 0.24 0.10 0.07 0.22 -0.03 0.16 0.13 -0.09 0.08 -0.04 -0.12 0.09 -0.14 -0.12 0.02 -0.01 0.11 -0.06 -0.22 0.06 -0.03 -0.20 0.07 -0.07 -0.15 -0.06 -0.01 -0.00 -0.03 0.03 0.11 -0.10 0.00 0.02 -0.12 -0.06 0.18 -0.17 -0.11 0.05 -0.09 0.02 0.14 0.06 -0.04 0.04 -0.03 -0.03 0.00 0.07 -0.01 0.12 0.01 0.02 0.03 0.08 -0.01 0.07 -0.05 -0.00 -0.02 -0.04 0.05 -0.07 -0.02 0.12 0.09 0.03 -0.19 0.01 0.02 0.08 0.06 -0.03 0.05 0.13 0.06 0.12 0.05 0.08 -0.12 0.08 0.01 -0.05 0.02 -0.05 -0.01 0.02 0.13 -0.16 0.01 0.01 0.03 0.02 -0.01 0.05 0.05 -0.02 0.01 0.00 -0.00 0.03 0.04 0.03 0.02 0.01 0.12 0.33 0.24 0.04 0.10 -0.01 0.01 0.01 -0.01 0.01 -0.00 -0.02 0.03 -0.06 -0.08 0.06 -0.06 -0.03 0.00 0.01 -0.00 0.01 -0.09 -0.07 0.18 0.27 0.19 0.13 0.14 0.13 0.06 0.15 -0.04 0.07 0.08 -0.03 -0.01 -0.04 -0.05 0.01 -0.05 -0.06 -0.04 -0.07 -0.06 0.04 -0.05 -0.09 0.03 -0.05 -0.07 0.01 -0.04 -0.02 -0.15 -0.06 -0.07 -0.11 -0.04 0.03 -0.14 -0.04 -0.10 0.00 0.02 0.00 0.00 0.00 -0.02 -0.00 -0.04 -0.07 -0.02 -0.03 0.02 -0.03 -0.03 0.01 -0.02 -0.02 0.02 -0.00 0.01 0.00 0.01 -0.00 0.01 -0.00 0.00 0.01 0.02 -0.06 0.01 0.24 -0.16 0.20 -0.04 -0.13 0.00 -0.05 0.01 -0.04 -0.01 -0.01 -0.04 -0.04 0.03 -0.04 0.07 -0.05 -0.05 0.01 -0.05 -0.02 0.11 -0.05 -0.07 -0.22 -0.23 0.02 -0.11 -0.11 0.06 0.03 -0.02 0.05 0.22 -0.07 0.15 0.09 0.02 -0.05 0.08 0.12 0.14 -0.03 -0.10 -0.15 0.08 0.05 0.02 0.20 0.04 -0.09 -0.04 -0.03 -0.08 0.06 -0.01 -0.00 0.00 -0.03 -0.12 -0.01 -0.01 -0.11 -0.10 0.02 0.20 0.01 -0.01 0.06 -0.03 -0.02 -0.10 -0.01 0.03 0.14 -0.06 0.09 -0.10 -0.05 0.06 -0.06 0.04 -0.07 0.02 0.04 0.01 0.01 0.01 -0.11 -0.06 0.05 -0.07 -0.09 0.00 -0.13 -0.04 -0.06 -0.03 -0.10 -0.08 -0.02 -0.08 -0.12 -0.03 0.02 -0.07 -0.07 0.14 -0.04 -0.09 0.13 -0.06 -0.06 0.11 -0.05 0.00 0.00 -0.04 -0.05 -0.00 -0.09 -0.01 -0.00 -0.16 -0.09 0.25 -0.21 -0.18 0.07 -0.12 0.02 0.19 0.05 -0.03 0.07 -0.00 -0.01 0.03 0.05 0.02 0.09 -0.04 0.04 -0.07 -0.14 0.07 -0.07 0.04 0.08 -0.01 -0.01 0.08 -0.09 0.03 0.04 -0.14 -0.04 0.18 -0.12 0.05 -0.03 -0.05 -0.08 -0.08 0.08 -0.01 0.02 0.02 0.02 0.10 0.02 -0.05 0.05 -0.01 0.23 0.07 -0.08 -0.12 0.05 -0.02 -0.03 -0.00 -0.01 -0.02 -0.02 -0.04 0.01 0.03 0.03 -0.03 -0.05 -0.07 -0.07 0.01 -0.01 -0.17 0.04 -0.01 0.07 0.07 0.04 0.10 -0.04 0.15 0.12 -0.08 0.10 0.05 -0.06 0.02 0.02 -0.07 0.00 0.09 -0.02 0.19 0.03 -0.02 0.05 -0.19 0.18 -0.03 -0.20 0.18 -0.01 0.05 0.03 0.05 0.02 -0.03 0.05 0.13 -0.00 0.15 0.11 0.02 0.15 0.11 -0.03 0.18 0.02 0.01 -0.01 -0.02 0.03 -0.02 0.02 -0.03 -0.03 0.01 -0.22 0.11 -0.02 -0.19 0.18 0.04 -0.20 0.04 -0.05 -0.14 -0.11 -0.03 -0.09 0.02 -0.07 -0.05 0.01 0.03 -0.05 -0.08 0.02 -0.02 -0.04 0.04 -0.09 -0.02 -0.14 0.18 -0.03 -0.15 0.15 0.02 -0.13 0.14 0.02 -0.02 0.02 -0.02 -0.05 0.03 -0.05 -0.01 0.02 -0.02 -0.04 0.07 -0.07 0.05 0.06 0.03 0.07 -0.08 -0.01 0.23 -0.01 -0.05 0.11 0.03 -0.04 -0.09 -0.10 0.09 -0.00 0.09 -0.02 0.01 0.07 -0.01 -0.06 -0.01 0.00 -0.07 0.06 -0.04 -0.02 -0.01 0.01 -0.02 -0.04 -0.06 0.02 0.03 0.03 -0.00 0.00 0.00 -0.05 -0.03 0.03 0.02 0.02 -0.03 0.21 0.12 0.17 -0.06 0.04 -0.04 -0.06 0.04 -0.02 0.17 -0.21 0.22 0.21 -0.25 0.14 -0.05 0.02 -0.07 0.08 -0.12 0.33 0.01 -0.03 -0.00 0.02 -0.04 0.01 0.20 0.14 0.15 0.17 -0.06 0.17 -0.07 -0.06 0.01 -0.04 -0.04 -0.01 -0.06 -0.05 -0.01 0.03 -0.00 0.04 0.03 -0.01 0.08 0.04 0.01 0.03 -0.07 0.00 -0.05 -0.07 -0.01 -0.07 -0.05 -0.05 -0.05 0.05 0.10 0.08 0.06 0.03 0.05 -0.02 -0.02 -0.07 0.03 0.04 -0.07 0.06 0.06 -0.01 0.01 0.03 -0.07 0.06 -0.10 -0.02 0.10 -0.11 -0.02 0.05 -0.10 -0.07 -0.10 0.02 -0.16 -0.06 -0.01 -0.03 0.01 -0.00 -0.01 -0.22 0.04 -0.14 -0.13 0.04 -0.05 -0.03 -0.15 -0.06 -0.03 -0.00 0.01 -0.00 0.03 -0.04 -0.00 -0.03 -0.03 0.04 0.11 -0.04 0.02 0.08 -0.05 -0.04 -0.04 0.04 -0.04 0.08 -0.06 0.02 -0.00 -0.00 0.01 0.02 0.03 -0.01 -0.02 -0.02 0.02 0.03 0.03 0.04 -0.01 -0.00 0.10 -0.03 -0.03 0.00 -0.01 0.03 0.17 -0.10 0.18 0.18 -0.11 0.11 0.05 -0.05 0.10 0.08 -0.07 0.06 0.16 -0.10 0.21 0.03 -0.03 0.13 0.10 -0.11 -0.00 0.11 -0.11 0.00 0.02 0.05 0.00 0.04 0.02 0.01 -0.01 0.02 -0.10 -0.03 -0.01 -0.09 -0.01 0.02 -0.12 -0.12 0.04 -0.11 -0.13 0.05 -0.08 -0.12 0.04 -0.13 -0.07 0.12 -0.08 -0.06 0.10 -0.14 -0.06 0.07 -0.05 0.06 -0.08 -0.12 0.04 -0.00 -0.15 0.19 0.14 0.13 0.07 -0.09 0.12 -0.02 -0.05 0.02 0.08 -0.11 0.16 -0.17 0.18 -0.11 -0.08 0.19 -0.07 -0.14 -0.03 -0.05 -0.03 0.01 -0.06 -0.02 -0.00 0.02 0.03 0.01 0.00 -0.06 -0.07 0.03 -0.06 -0.08 0.02 -0.08 -0.04 0.02 -0.11 0.04 0.06 0.00 -0.04 0.12 0.11 0.20 0.00 0.01 0.01 0.04 -0.06 0.05 -0.00 0.05 -0.01 0.01 0.04 -0.02 -0.01 0.01 0.01 0.00 0.01 0.02 0.02 0.00 0.01 0.00 0.01 0.01 0.01 0.02 0.01 -0.00 -0.05 0.05 0.06 -0.17 -0.09 -0.17 -0.02 -0.00 -0.04 -0.02 0.00 -0.02 0.19 -0.02 0.20 0.11 -0.04 0.12 -0.02 0.03 -0.02 0.10 0.09 0.31 -0.09 -0.00 0.11 -0.08 0.05 0.12 -0.17 0.07 -0.12 -0.22 0.07 -0.14 0.02 0.13 -0.07 0.02 0.05 -0.06 -0.05 0.09 -0.09 0.02 -0.01 0.14 0.02 -0.01 0.09 0.03 -0.03 0.12 -0.07 -0.05 -0.12 -0.11 -0.01 -0.07 -0.08 -0.06 -0.11 -0.01 -0.05 -0.03 -0.05 0.05 -0.07 0.12 0.02 0.04 -0.11 0.00 -0.04 -0.06 -0.03 -0.00 -0.09 0.03 -0.04 0.01 0.02 0.07 -0.04 0.03 0.04 0.01 0.07 0.09 -0.09 -0.01 -0.14 0.04 -0.08 -0.07 -0.05 -0.13 0.04 0.15 -0.11 0.16 0.05 -0.11 0.05 -0.24 0.19 -0.00 0.11 -0.02 -0.04 0.02 -0.01 -0.00 0.06 -0.04 -0.02 0.06 -0.02 -0.11 0.07 -0.03 -0.11 0.03 -0.01 0.03 0.11 0.00 -0.08 -0.01 0.00 -0.01 -0.01 -0.00 -0.01 -0.00 0.01 -0.00 -0.01 -0.02 -0.03 -0.01 0.00 -0.01 0.27 0.06 -0.09 0.05 0.03 0.01 -0.02 -0.02 -0.07 -0.04 0.01 0.00 -0.03 -0.00 -0.02 -0.04 0.00 -0.02 -0.02 0.04 -0.03 -0.01 0.01 -0.03 0.24 0.08 -0.09 0.26 -0.04 -0.02 0.04 -0.01 0.03 0.01 -0.01 0.03 0.13 -0.05 0.04 0.09 -0.02 0.05 0.12 -0.08 0.09 -0.06 0.06 0.21 0.01 0.04 0.06 -0.00 0.05 0.11 -0.05 -0.06 0.10 0.04 -0.09 0.09 -0.01 -0.04 0.01 -0.00 -0.15 -0.10 0.00 -0.10 -0.03 0.01 0.02 0.10 -0.07 0.08 -0.01 -0.02 0.03 0.00 -0.05 0.12 -0.03 -0.00 0.08 0.14 -0.08 0.14 0.08 0.02 0.05 0.24 -0.04 -0.03 0.00 0.13 -0.10 -0.03 -0.14 -0.16 0.02 -0.03 0.02 -0.04 0.05 -0.01 -0.01 -0.04 0.03 -0.04 -0.20 0.05 0.09 -0.08 0.03 0.06 0.13 0.14 -0.07 0.09 -0.05 -0.24 0.12 -0.14 -0.22 -0.01 -0.00 0.00 0.16 0.05 -0.11 -0.02 -0.00 0.00 -0.01 -0.02 -0.02 0.01 0.01 0.02 -0.02 -0.02 -0.01 -0.03 0.00 0.00 0.07 0.00 -0.06 0.02 -0.03 -0.19 -0.00 0.02 0.03 -0.00 0.02 0.01 0.07 0.00 0.04 0.03 0.00 0.04 -0.00 -0.03 0.00 0.04 0.04 0.07 0.08 0.05 -0.09 0.08 -0.02 -0.08 -0.08 0.03 -0.02 -0.26 0.01 -0.08 -0.00 -0.03 0.09 0.04 0.01 0.06 -0.03 -0.06 0.10 -0.06 0.04 -0.07 -0.06 0.03 -0.05 -0.05 0.05 -0.10 -0.04 -0.12 0.01 0.01 -0.13 0.02 -0.03 -0.10 -0.02 -0.04 0.07 0.07 -0.01 -0.00 0.11 -0.16 -0.06 -0.07 0.13 -0.01 0.05 0.07 0.03 0.01 0.10 -0.05 0.04 0.01 -0.05 -0.07 0.02 -0.10 -0.04 -0.01 0.02 -0.14 -0.02 0.00 -0.03 -0.01 -0.00 -0.01 0.00 -0.01 -0.00 0.15 0.03 0.00 0.11 0.01 -0.09 -0.49 0.46 -0.24 -0.09 0.01 0.02 -0.02 0.00 -0.01 -0.01 0.02 -0.02 -0.00 0.02 0.03 -0.04 0.04 0.01 -0.02 -0.01 0.02 0.02 0.00 0.00 -0.01 -0.01 0.01 -0.01 -0.02 -0.03 0.00 0.01 0.02 -0.01 -0.01 -0.01 -0.03 -0.00 0.00 -0.01 -0.05 -0.06 -0.09 0.03 0.02 -0.10 0.05 -0.11 -0.11 0.07 -0.05 0.04 -0.10 0.02 0.04 -0.11 -0.01 -0.10 0.09 -0.09 0.02 -0.06 0.05 0.05 -0.01 -0.13 0.04 -0.08 -0.15 -0.05 0.09 -0.04 -0.00 -0.01 -0.01 0.11 0.08 -0.04 0.05 0.04 0.00 0.08 0.04 -0.00 0.13 -0.08 -0.17 0.11 -0.07 -0.02 0.07 -0.01 -0.03 -0.03 -0.04 0.01 -0.03 -0.07 -0.03 -0.01 -0.09 0.01 -0.01 -0.14 -0.10 -0.03 -0.03 -0.08 0.11 0.06 0.13 0.04 0.07 -0.00 0.05 0.07 0.01 0.01 0.08 -0.04 0.05 0.05 0.21 -0.08 0.13 0.11 0.05 0.11 0.28 0.03 0.03 -0.01 -0.14 0.10 0.04 0.12 0.17 -0.03 -0.01 -0.05 0.07 0.02 -0.06 0.09 0.16 -0.15 0.13 -0.11 -0.01 0.01 -0.01 -0.04 -0.01 -0.08 0.05 0.02 -0.09 0.10 0.25 -0.12 0.13 0.25 -0.03 -0.01 0.01 -0.20 0.02 0.17 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.02 0.01 -0.02 -0.17 0.05 0.10 0.00 0.01 0.01 0.00 0.01 -0.00 0.02 -0.02 0.03 -0.01 -0.03 -0.02 -0.00 -0.01 0.00 0.02 0.03 0.04 0.02 0.03 -0.02 0.02 -0.00 -0.01 -0.05 0.01 -0.08 0.14 0.01 -0.02 -0.01 -0.00 -0.01 -0.01 -0.02 -0.01 -0.01 -0.00 -0.02 -0.04 0.02 -0.00 -0.03 0.02 -0.01 -0.03 0.02 -0.03 0.00 -0.05 0.02 0.00 -0.05 0.03 -0.00 -0.04 0.01 -0.02 0.03 0.03 -0.02 0.01 0.01 -0.03 -0.01 -0.02 0.04 -0.01 0.02 0.02 0.00 0.01 0.03 -0.02 0.02 0.00 -0.02 -0.03 0.01 -0.04 -0.02 -0.01 0.01 -0.06 -0.01 -0.01 -0.02 0.01 -0.02 -0.02 -0.01 -0.03 0.01 0.01 0.05 0.04 0.00 0.08 0.09 0.78 -0.41 0.31 -0.02 -0.00 0.00 -0.00 -0.01 0.00 0.01 0.01 -0.01 0.01 0.00 -0.03 0.00 0.00 -0.03 -0.00 -0.00 0.01 0.03 0.01 -0.02 -0.01 -0.00 0.01 0.00 -0.02 -0.02 0.00 0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.01 -0.09 0.03 0.07 0.06 -0.02 0.03 -0.16 0.15 -0.05 -0.14 0.12 -0.13 -0.02 0.02 -0.02 -0.02 0.03 0.00 -0.18 0.11 -0.07 -0.01 0.01 -0.03 -0.10 0.01 0.09 -0.11 -0.00 0.08 0.05 -0.02 0.04 0.04 -0.01 0.04 0.05 0.04 -0.04 0.01 0.02 -0.02 0.05 0.04 -0.03 -0.22 0.11 -0.05 -0.18 0.09 -0.04 -0.15 0.12 -0.21 0.01 0.05 -0.01 -0.03 0.08 0.02 0.02 0.05 -0.02 0.01 -0.06 -0.06 -0.00 -0.02 -0.05 0.04 -0.07 -0.08 0.32 -0.09 0.13 0.16 0.01 0.03 0.18 -0.17 0.04 0.05 -0.00 0.18 -0.06 0.04 0.12 -0.00 0.28 0.04 -0.01 -0.01 0.00 0.07 -0.04 -0.00 -0.05 -0.07 0.01 -0.06 -0.05 -0.00 -0.04 -0.06 0.02 -0.15 -0.02 -0.03 0.06 -0.10 -0.09 0.09 -0.15 -0.05 0.11 -0.03 -0.09 0.04 -0.04 -0.10 0.00 0.03 -0.14 -0.01 -0.02 0.01 0.15 -0.04 -0.13 0.00 -0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.01 0.01 -0.00 0.01 0.05 -0.00 -0.00 -0.00 0.08 -0.14 -0.01 -0.01 -0.01 -0.00 -0.01 -0.00 -0.11 -0.07 0.10 -0.00 -0.01 -0.01 0.01 0.01 -0.01 0.01 0.00 -0.00 0.01 0.00 0.01 0.01 -0.00 0.01 0.03 0.04 -0.03 0.01 0.02 -0.02 0.01 0.02 -0.01 0.01 -0.00 0.01 0.01 -0.00 0.00 0.01 -0.01 0.01 0.01 -0.01 0.01 0.01 -0.01 0.01 0.01 -0.01 0.01 -0.01 0.01 0.01 -0.03 0.03 -0.00 0.02 0.01 0.01 -0.02 -0.00 -0.01 -0.01 -0.01 -0.01 -0.00 0.01 0.00 -0.02 -0.06 0.03 -0.09 -0.05 -0.00 -0.22 0.70 -0.62 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.02 -0.03 0.01 -0.01 -0.03 0.01 -0.05 -0.01 0.00 -0.01 0.01 0.01 -0.01 0.01 0.01 0.02 0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.01 -0.01 0.01 0.01 -0.01 -0.00 0.00 -0.01 0.00 0.01 0.03 0.03 0.01 -0.01 0.01 0.03 -0.01 -0.02 0.08 -0.09 0.08 -0.01 -0.01 0.02 0.02 -0.05 0.09 0.01 0.10 -0.01 0.03 0.11 0.02 0.09 -0.01 -0.06 0.00 0.07 -0.01 0.04 0.08 -0.06 0.04 0.02 -0.06 0.09 -0.07 0.06 0.10 -0.02 0.06 0.00 0.28 -0.12 -0.05 0.17 -0.07 -0.11 0.20 -0.08 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.02 0.07 -0.21 0.02 0.09 -0.19 0.10 0.01 -0.11 0.02 -0.09 0.04 0.06 -0.16 0.18 -0.07 0.14 0.12 0.13 0.00 -0.01 0.02 -0.02 0.00 -0.01 0.01 -0.02 0.03 0.02 -0.03 -0.09 0.01 -0.06 -0.07 0.13 -0.36 0.27 0.00 0.00 -0.00 -0.02 0.01 -0.03 0.01 0.00 0.01 -0.14 -0.14 0.04 -0.15 -0.12 0.10 -0.26 -0.15 0.02 -0.03 0.00 0.01 0.00 -0.03 0.04 -0.04 0.06 0.04 0.00 -0.01 -0.01 0.01 -0.03 -0.00 0.00 0.03 -0.02 -0.02 0.00 0.01 -0.02 0.00 0.01 -0.02 -0.01 -0.03 0.02 0.03 0.05 -0.02 -0.02 -0.00 -0.02 -0.00 0.01 -0.01 -0.02 0.00 0.06 -0.12 0.04 -0.00 0.00 -0.02 -0.03 0.05 -0.03 0.18 0.36 0.06 0.11 0.40 0.13 -0.06 0.00 0.04 0.08 0.32 0.13 0.01 -0.01 -0.01 0.00 -0.03 -0.01 0.06 -0.25 0.04 0.10 0.01 0.02 -0.07 -0.08 0.05 -0.01 -0.09 0.02 -0.10 -0.07 -0.01 0.03 -0.01 -0.02 0.02 -0.01 -0.02 0.01 -0.02 0.01 -0.14 -0.07 -0.11 -0.09 -0.06 -0.07 -0.17 -0.01 -0.11 0.09 -0.03 -0.07 0.11 -0.02 -0.02 0.08 0.03 0.01 -0.01 0.02 -0.02 0.02 0.00 0.00 -0.00 0.03 -0.02 -0.01 0.02 0.07 -0.01 0.07 0.03 -0.08 0.22 -0.15 -0.02 -0.00 -0.05 0.01 -0.01 -0.10 -0.00 -0.07 0.04 -0.04 0.06 -0.05 -0.04 0.09 -0.01 0.22 -0.13 0.05 -0.01 0.00 0.00 0.01 -0.00 0.00 0.02 0.02 -0.01 -0.02 -0.06 0.10 -0.02 -0.02 0.09 0.01 0.06 -0.01 0.04 -0.06 0.08 -0.02 -0.00 -0.00 -0.03 -0.01 -0.02 0.00 0.02 0.02 -0.03 -0.04 -0.03 -0.00 -0.00 -0.00 -0.01 0.01 0.00 0.01 -0.01 0.02 0.04 -0.06 -0.01 0.01 -0.00 0.10 0.03 0.06 0.01 0.02 0.07 0.03 0.07 -0.04 -0.02 0.03 0.05 0.02 -0.02 -0.04 0.03 -0.02 -0.04 0.04 0.02 -0.04 0.01 0.03 0.00 0.01 0.32 -0.02 -0.06 0.24 -0.04 -0.03 0.31 -0.05 -0.04 0.01 0.00 -0.00 0.04 -0.01 0.03 0.01 0.05 0.01 -0.11 0.12 -0.02 -0.13 0.11 -0.05 -0.04 0.04 -0.06 -0.18 0.01 0.12 -0.15 -0.14 0.16 -0.39 -0.29 -0.23 0.01 0.11 0.06 0.02 0.09 0.05 0.03 0.13 0.07 -0.00 -0.02 -0.09 -0.05 -0.14 0.02 0.04 -0.08 0.10 -0.01 0.00 -0.01 0.02 -0.01 -0.01 -0.03 -0.03 -0.00 -0.04 -0.02 0.00 0.08 -0.10 0.04 0.06 -0.04 0.03 0.00 -0.04 -0.04 -0.07 0.02 -0.10 0.07 -0.15 -0.13 -0.00 -0.01 0.02 -0.02 0.03 0.01 0.02 -0.01 0.03 0.04 -0.02 -0.00 -0.01 -0.02 0.01 -0.02 -0.04 -0.03 -0.00 -0.02 0.02 -0.02 0.00 0.03 -0.00 -0.01 -0.00 -0.08 0.02 0.06 -0.00 0.00 -0.01 0.11 -0.14 -0.06 -0.01 0.08 0.12 -0.02 -0.02 -0.01 -0.01 -0.03 -0.02 0.04 -0.10 0.03 -0.01 -0.02 -0.02 -0.03 0.03 0.02 -0.06 -0.02 -0.05 -0.00 0.02 0.00 -0.02 -0.02 0.00 -0.14 0.02 0.02 -0.10 0.03 -0.00 -0.13 0.04 0.00 0.00 0.00 0.01 0.14 -0.07 0.15 0.03 0.21 0.00 0.06 -0.05 0.01 0.05 -0.03 0.04 0.03 -0.01 0.02 0.09 -0.01 -0.03 0.11 0.00 -0.00 0.06 -0.05 -0.08 0.04 0.34 0.19 0.05 0.29 0.14 0.07 0.40 0.19 -0.04 0.04 -0.00 0.02 0.04 0.01 -0.05 0.05 -0.09 0.00 -0.00 0.00 0.02 -0.01 0.00 -0.00 -0.01 0.00 0.01 0.00 0.00 -0.05 0.04 -0.01 -0.03 0.00 -0.01 -0.03 -0.17 -0.16 -0.13 -0.16 -0.16 -0.21 -0.22 -0.08 0.02 -0.00 -0.02 0.01 0.03 -0.04 -0.01 -0.02 -0.01 0.05 -0.02 -0.05 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.05 -0.05 -0.07 -0.00 -0.00 0.00 0.00 -0.01 -0.00 0.00 -0.01 0.01 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.00 0.02 0.02 -0.00 -0.01 -0.00 -0.04 0.02 -0.02 0.01 -0.07 0.14 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.03 0.01 -0.00 -0.02 0.01 -0.01 -0.02 0.02 -0.01 0.01 -0.00 -0.00 0.02 -0.01 -0.02 0.00 0.01 0.01 0.02 -0.01 -0.00 -0.02 0.01 0.02 0.01 -0.01 0.01 0.02 0.00 0.01 0.03 -0.02 0.03 -0.06 -0.23 -0.27 -0.01 0.01 -0.01 -0.00 0.00 -0.01 -0.01 0.01 -0.02 -0.01 0.02 0.00 0.00 -0.04 0.07 -0.00 0.02 0.03 0.01 0.00 0.00 -0.05 0.03 0.00 0.04 0.05 -0.01 0.00 -0.00 0.00 -0.02 0.01 -0.00 -0.01 -0.00 0.00 -0.01 -0.02 0.04 0.04 -0.04 0.04 0.80 0.10 -0.39 -0.01 0.00 0.01 -0.02 -0.03 0.01 -0.00 0.01 -0.01 -0.06 -0.00 0.02 -0.00 0.00 0.00 -0.01 0.00 -0.00 0.00 0.01 0.00 -0.01 -0.01 -0.01 0.01 -0.01 0.00 -0.02 0.01 0.00 0.01 0.01 -0.02 0.00 -0.00 0.01 -0.01 0.02 0.02 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.02 -0.04 -0.03 0.00 0.00 -0.00 -0.02 0.00 0.01 -0.02 -0.05 0.02 -0.00 -0.00 -0.00 -0.02 -0.00 -0.01 0.03 -0.04 0.03 -0.01 -0.05 0.05 0.02 -0.04 0.03 0.00 -0.00 -0.00 0.01 -0.01 0.02 0.01 0.02 -0.00 -0.00 0.02 -0.00 -0.02 0.02 -0.00 0.00 0.00 -0.00 -0.06 0.03 -0.02 -0.17 0.26 -0.22 0.41 0.42 0.42 0.00 0.03 -0.01 0.01 0.02 -0.01 0.02 0.03 0.01 0.01 -0.03 -0.02 -0.06 0.05 -0.11 0.01 0.00 0.02 -0.00 0.00 0.00 0.04 -0.02 -0.01 -0.03 -0.03 0.00 0.01 0.01 -0.01 0.04 0.01 0.02 -0.01 -0.01 -0.00 -0.00 -0.07 -0.01 0.11 -0.23 0.18 0.29 0.29 -0.02 0.00 0.00 0.00 0.00 0.02 0.00 0.01 -0.00 0.00 0.02 0.00 -0.00 0.00 0.00 0.00 -0.01 0.02 0.02 -0.00 0.02 -0.02 0.02 -0.01 -0.01 0.01 -0.03 0.02 -0.04 0.08 -0.03 -0.00 0.02 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.02 -0.06 0.00 -0.02 -0.00 0.00 0.00 -0.03 0.05 0.01 -0.01 -0.02 -0.02 -0.02 -0.03 -0.04 0.00 0.00 -0.00 0.02 0.02 0.00 -0.01 0.01 -0.01 -0.01 0.00 -0.01 -0.01 0.01 -0.01 0.01 -0.01 -0.01 -0.06 0.02 0.17 0.00 0.00 0.00 0.01 -0.01 0.01 -0.01 -0.02 -0.02 -0.01 -0.02 0.04 0.01 -0.00 0.00 0.01 -0.02 0.01 -0.03 -0.05 -0.05 -0.00 0.00 -0.00 0.00 0.00 0.01 -0.01 -0.00 -0.01 -0.00 0.00 0.00 0.01 -0.01 0.01 -0.00 -0.00 0.00 -0.03 -0.00 -0.01 0.55 -0.25 -0.13 -0.34 -0.49 0.10 -0.00 -0.00 -0.00 -0.01 -0.00 -0.01 -0.01 0.01 -0.01 0.00 0.00 0.01 0.01 0.01 -0.01 0.06 -0.00 -0.03 -0.00 0.04 0.04 0.02 0.23 0.01 -0.00 -0.04 0.03 0.34 0.06 -0.01 -0.00 -0.02 0.02 -0.10 0.10 0.20 -0.01 0.22 -0.14 0.11 -0.17 -0.17 0.02 -0.24 0.18 0.00 -0.07 0.03 -0.01 -0.00 -0.00 -0.01 -0.01 -0.00 -0.03 0.03 0.03 0.01 0.01 0.01 -0.05 0.03 0.09 -0.01 -0.01 0.01 0.07 -0.04 -0.05 0.01 0.01 0.01 0.01 0.00 0.01 0.01 -0.00 -0.03 0.06 0.17 -0.03 -0.04 0.02 -0.03 -0.03 -0.07 -0.02 -0.07 0.02 -0.07 0.00 0.01 0.01 0.00 0.01 -0.10 -0.04 -0.02 0.08 0.01 -0.01 0.00 0.03 0.00 0.05 0.00 0.04 -0.03 0.01 -0.00 0.00 0.01 0.00 -0.01 0.02 -0.04 -0.04 0.03 0.03 -0.01 0.11 0.04 0.11 0.01 0.02 -0.02 -0.00 0.01 0.00 0.01 -0.00 0.01 0.00 -0.01 0.00 -0.01 0.01 0.01 -0.39 0.17 0.14 0.15 0.38 -0.17 -0.00 -0.00 -0.00 -0.02 0.02 0.01 -0.03 -0.02 -0.01 -0.01 -0.01 -0.01 0.01 0.02 -0.06 -0.03 -0.06 -0.02 -0.01 0.00 -0.01 -0.11 0.09 -0.09 0.02 -0.23 0.18 -0.03 -0.12 -0.18 0.03 0.00 -0.03 -0.16 0.10 -0.11 0.17 0.10 0.10 -0.16 -0.15 0.08 0.25 -0.04 -0.07 0.02 0.01 -0.02 0.00 -0.02 -0.01 -0.03 -0.01 0.00 -0.07 0.08 0.15 -0.03 -0.03 0.01 0.10 -0.06 -0.09 -0.00 0.01 -0.00 0.04 -0.05 -0.05 -0.00 -0.00 0.00 0.01 0.02 0.02 -0.01 0.01 0.01 -0.06 -0.09 0.01 -0.03 0.02 -0.03 0.07 -0.06 -0.06 -0.08 0.02 -0.11 -0.00 0.01 0.00 -0.11 0.08 -0.41 -0.06 -0.24 0.04 0.01 0.00 0.01 -0.00 0.00 -0.00 -0.01 0.00 0.05 0.01 -0.00 -0.00 0.02 -0.00 0.02 -0.02 -0.02 -0.02 -0.02 -0.02 0.02 0.07 -0.15 -0.02 0.07 0.09 -0.01 -0.00 0.00 0.00 -0.01 -0.00 0.00 -0.00 0.01 -0.00 0.01 0.02 0.01 0.11 -0.02 -0.16 -0.10 -0.14 0.02 0.00 -0.00 0.01 -0.03 0.02 0.01 -0.00 -0.02 0.01 0.00 0.01 -0.00 -0.04 0.02 0.00 -0.04 -0.02 0.01 0.00 0.01 -0.01 0.07 -0.23 0.08 0.33 0.14 -0.08 -0.24 0.10 0.18 0.01 -0.00 -0.01 -0.01 0.01 -0.02 0.03 -0.00 0.03 -0.04 -0.01 0.01 0.03 0.02 -0.03 -0.04 -0.02 0.04 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 0.01 -0.02 0.01 0.01 -0.02 0.02 0.03 0.00 0.01 0.00 0.06 -0.04 -0.07 0.00 0.00 -0.01 -0.01 -0.01 -0.04 0.00 0.00 -0.00 0.00 0.02 -0.00 -0.01 0.00 -0.00 0.04 0.00 -0.02 -0.02 -0.00 -0.02 0.01 -0.01 0.00 -0.05 0.00 0.36 -0.01 0.09 0.09 0.00 -0.00 0.01 0.04 0.00 0.04 0.01 0.04 -0.04 0.00 -0.00 -0.00 0.01 0.00 0.02 -0.01 -0.01 -0.01 -0.01 -0.01 -0.01 -0.01 -0.02 -0.02 -0.02 -0.00 -0.03 -0.00 -0.00 -0.00 -0.01 -0.01 0.00 0.00 0.01 0.01 -0.01 -0.02 -0.01 -0.15 0.02 0.30 0.11 0.23 -0.12 -0.00 -0.00 0.00 -0.01 -0.01 -0.02 0.02 0.01 0.00 0.00 0.00 0.01 0.02 -0.01 0.02 0.03 0.02 0.00 -0.00 -0.01 0.01 -0.15 0.44 -0.17 0.06 -0.08 0.05 0.44 -0.19 -0.35 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.00 -0.00 -0.01 0.00 -0.16 -0.00 0.24 -0.00 0.00 0.00 0.01 -0.01 0.02 0.00 0.00 0.00 -0.01 -0.00 -0.02 0.02 -0.00 -0.02 -0.00 0.02 0.01 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.01 0.29 0.01 0.08 -0.00 0.01 0.03 0.06 0.15 -0.03 -0.04 -0.05 0.11 -0.00 0.00 -0.00 0.04 -0.02 0.03 0.02 0.04 -0.03 0.00 0.00 -0.01 0.03 -0.01 -0.02 0.00 0.01 -0.01 0.00 0.00 -0.00 0.01 0.05 0.05 0.01 0.01 0.01 -0.00 -0.00 0.00 -0.03 0.01 -0.04 0.00 -0.01 0.01 0.00 -0.01 -0.01 -0.10 -0.03 -0.01 0.01 0.08 0.09 0.00 0.00 0.00 -0.01 0.01 -0.04 0.01 -0.01 0.02 -0.02 -0.03 0.00 0.01 -0.29 -0.49 0.33 0.54 -0.08 0.00 -0.00 -0.00 -0.00 -0.01 0.02 0.00 0.02 0.01 -0.00 -0.00 -0.00 0.01 -0.02 0.01 0.00 -0.00 0.00 -0.04 -0.00 0.01 0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.03 -0.00 0.04 0.00 -0.00 -0.01 -0.04 0.08 -0.12 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.14 -0.02 0.10 0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.05 -0.00 0.01 0.00 0.02 0.00 -0.01 0.05 0.00 0.04 0.03 0.03 -0.00 0.00 -0.00 0.04 -0.02 0.05 0.02 0.05 -0.02 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.02 -0.01 -0.03 -0.00 -0.01 0.01 -0.20 0.01 -0.20 0.06 0.10 -0.00 0.00 -0.00 -0.01 -0.01 -0.04 0.01 0.01 -0.01 0.00 0.02 0.03 0.54 0.22 -0.02 -0.06 -0.45 -0.49 0.00 0.00 0.00 -0.01 0.00 -0.02 0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.01 -0.04 -0.07 0.04 0.08 -0.01 0.00 -0.02 -0.00 0.01 -0.08 0.08 0.05 0.11 0.03 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.01 -0.01 -0.02 -0.00 0.00 -0.00 -0.02 0.01 -0.02 -0.00 0.01 0.01 0.03 0.00 -0.00 -0.01 0.00 0.01 -0.01 -0.02 0.02 -0.12 0.03 0.02 -0.00 -0.04 -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 -0.01 0.01 0.02 -0.02 -0.04 0.01 -0.00 -0.02 -0.02 0.03 0.03 0.01 0.01 0.00 0.01 0.02 0.02 0.00 0.00 -0.00 -0.05 -0.06 -0.01 -0.00 -0.01 -0.00 0.03 0.01 -0.02 0.00 0.00 -0.01 -0.01 0.01 -0.02 0.31 -0.16 0.51 0.16 0.49 -0.20 -0.00 0.00 -0.00 0.02 0.02 0.04 0.01 0.02 -0.04 0.01 0.00 -0.00 0.02 -0.02 0.04 -0.05 0.00 0.00 -0.01 -0.02 -0.00 -0.16 0.01 -0.18 -0.01 -0.04 0.03 -0.00 -0.00 -0.00 -0.07 -0.02 -0.01 0.01 0.05 0.06 0.02 0.02 0.01 -0.03 0.05 -0.29 -0.03 -0.09 0.07 0.00 0.00 0.00 -0.01 0.04 0.06 -0.04 -0.08 0.01 0.00 0.01 0.00 -0.03 -0.02 0.05 -0.02 0.04 0.03 -0.01 -0.02 -0.01 0.05 -0.02 0.03 0.02 0.00 -0.01 -0.25 -0.09 -0.06 -0.01 -0.01 0.01 -0.01 -0.02 0.01 -0.01 0.02 0.01 0.01 -0.00 -0.00 0.02 -0.01 -0.01 0.00 0.27 -0.10 0.01 -0.03 -0.03 -0.00 0.00 0.00 -0.01 0.02 0.03 -0.01 0.01 -0.00 0.06 0.02 0.04 0.01 -0.00 -0.01 0.06 -0.10 -0.08 -0.01 -0.02 -0.01 -0.01 0.00 -0.01 -0.00 -0.00 -0.00 -0.04 0.01 -0.02 -0.00 0.00 -0.00 0.02 0.02 -0.02 -0.00 0.00 -0.00 -0.01 0.00 -0.00 0.28 -0.13 -0.00 0.08 0.25 -0.12 0.01 -0.00 0.00 -0.07 -0.04 -0.11 -0.03 -0.08 0.12 0.00 0.00 -0.00 0.03 -0.03 0.05 -0.07 0.00 0.01 -0.01 -0.01 0.00 -0.08 -0.02 -0.12 0.02 0.01 0.01 -0.00 -0.00 -0.00 -0.04 -0.00 -0.01 0.00 0.03 0.03 -0.03 -0.03 -0.01 0.07 -0.09 0.47 -0.02 0.16 -0.21 -0.00 0.00 0.00 -0.01 0.00 -0.00 0.02 -0.01 0.01 0.01 -0.00 -0.00 -0.01 -0.03 0.05 0.00 0.05 0.03 0.02 0.03 -0.00 0.03 -0.21 0.06 0.03 0.07 -0.03 0.23 0.29 0.34 0.04 -0.00 -0.00 -0.02 0.04 -0.02 0.04 -0.02 -0.04 -0.01 -0.04 0.04 -0.02 0.02 0.01 0.04 0.06 -0.05 -0.01 0.03 0.02 -0.00 -0.00 0.00 0.06 -0.12 -0.25 0.00 -0.00 -0.01 -0.07 0.01 0.02 -0.08 -0.01 0.06 -0.08 0.06 0.07 -0.01 -0.00 -0.00 0.02 -0.01 0.05 -0.00 -0.00 0.00 0.04 0.08 0.00 0.01 -0.01 0.01 -0.10 -0.00 0.06 0.03 -0.02 0.08 -0.00 0.00 -0.00 0.13 -0.06 0.06 0.04 0.14 -0.04 0.00 0.00 -0.00 -0.03 -0.01 -0.05 -0.00 -0.04 0.03 -0.02 -0.01 0.02 -0.15 0.23 -0.27 0.42 -0.09 -0.13 0.00 -0.00 0.01 -0.08 0.14 0.09 -0.12 -0.15 0.03 0.00 0.02 0.00 0.14 -0.04 0.09 -0.01 -0.11 -0.09 -0.01 -0.00 -0.01 -0.02 -0.00 0.11 0.14 0.00 0.17 -0.00 0.00 -0.00 0.04 -0.02 -0.00 -0.00 0.02 -0.01 -0.01 0.02 0.01 -0.02 0.21 -0.25 -0.03 -0.32 -0.14 0.00 0.00 -0.00 -0.01 -0.05 0.00 -0.07 -0.02 -0.03 0.06 0.06 0.07 0.05 -0.01 -0.00 -0.04 0.04 -0.02 0.04 -0.02 -0.06 0.01 -0.04 0.06 -0.05 0.03 0.01 -0.04 0.09 0.01 -0.01 0.05 0.03 -0.00 0.00 0.01 0.05 -0.09 -0.09 0.00 -0.00 -0.02 -0.15 0.01 -0.01 0.02 -0.04 -0.05 -0.19 0.16 0.17 0.00 -0.00 0.00 -0.02 -0.01 -0.05 0.00 -0.00 0.00 0.06 0.09 0.01 -0.00 0.00 -0.01 -0.01 0.06 -0.02 0.04 0.02 0.01 0.00 -0.00 0.01 0.03 -0.01 -0.09 0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.03 -0.01 -0.04 -0.02 -0.03 0.05 0.02 0.01 -0.01 0.12 -0.20 0.20 -0.34 0.07 0.10 0.00 0.01 -0.01 -0.04 0.09 0.03 -0.05 -0.07 0.02 0.00 -0.01 -0.00 -0.14 0.03 -0.08 0.02 0.10 0.12 -0.01 -0.00 -0.02 -0.07 0.02 0.11 0.31 -0.05 0.44 0.01 -0.00 -0.00 -0.02 0.04 0.05 -0.07 -0.06 -0.00 0.00 -0.02 -0.01 0.07 -0.17 0.17 0.03 0.26 0.11 0.00 0.00 -0.00 -0.03 -0.00 -0.02 -0.12 -0.05 -0.03 0.09 0.03 0.03 -0.03 -0.05 0.02 -0.05 -0.07 0.03 -0.02 0.06 -0.01 0.07 0.01 0.01 0.01 0.04 -0.06 0.03 0.04 -0.04 -0.01 0.05 0.03 0.00 -0.00 -0.01 -0.09 0.18 0.41 -0.01 0.00 -0.01 -0.00 -0.05 -0.22 0.08 0.13 0.01 -0.12 0.20 0.13 -0.00 -0.00 -0.00 0.02 0.03 0.03 0.00 0.01 -0.00 0.00 -0.31 0.04 0.01 -0.00 0.01 -0.01 -0.01 0.02 -0.00 -0.01 0.01 -0.00 -0.00 0.00 0.02 -0.01 -0.07 -0.05 0.00 0.10 0.00 0.00 0.00 -0.02 -0.02 -0.05 -0.02 -0.02 0.06 -0.01 -0.01 0.01 -0.05 0.07 -0.09 0.13 -0.03 -0.04 -0.00 -0.02 0.00 0.09 -0.22 -0.14 0.15 0.21 -0.08 -0.00 0.00 0.01 0.07 -0.02 0.04 -0.02 -0.02 -0.10 -0.01 -0.00 -0.01 -0.05 0.02 0.04 0.25 -0.06 0.38 0.00 -0.00 -0.00 0.02 -0.01 0.01 -0.02 0.01 -0.01 0.00 0.01 0.00 -0.08 0.06 -0.03 -0.02 -0.09 -0.04 0.00 -0.00 0.01 -0.09 0.05 -0.05 0.03 0.09 -0.06 0.14 -0.01 -0.03 -0.02 0.02 -0.04 0.05 0.03 0.02 0.02 -0.03 0.04 -0.07 0.05 -0.05 -0.00 -0.08 0.00 0.02 0.06 -0.04 -0.26 0.12 0.38 -0.00 0.00 -0.01 -0.00 0.01 0.21 0.01 -0.01 -0.00 -0.17 -0.01 -0.03 0.08 0.10 -0.01 -0.02 0.14 0.05 -0.00 -0.00 0.00 0.01 0.00 0.02 -0.03 -0.01 -0.00 0.53 0.19 0.14 0.00 -0.00 0.00 0.03 -0.12 0.01 -0.01 0.04 -0.11 -0.01 -0.00 -0.00 0.11 -0.05 -0.01 0.00 0.10 0.02 0.00 0.00 0.00 -0.06 -0.01 -0.04 -0.03 -0.04 0.09 -0.00 -0.00 0.00 -0.01 0.01 -0.02 0.02 -0.00 -0.00 0.00 -0.00 -0.00 0.04 -0.07 -0.04 0.04 0.07 -0.05 -0.00 -0.00 0.00 0.03 -0.01 0.02 -0.02 0.00 -0.06 0.00 -0.00 -0.00 -0.05 0.02 -0.04 0.09 -0.01 0.11 0.04 -0.00 -0.02 -0.07 0.14 0.13 -0.32 -0.10 -0.07 0.00 0.00 -0.00 -0.02 0.01 -0.00 -0.01 -0.01 -0.00 0.00 0.00 0.00 -0.05 -0.04 -0.01 0.01 -0.06 0.01 0.05 0.04 0.05 0.02 0.01 -0.02 0.02 0.04 0.01 0.03 -0.03 -0.02 -0.03 0.00 0.02 -0.04 -0.02 0.01 0.00 -0.05 0.01 0.14 -0.06 -0.20 -0.01 0.00 -0.03 0.09 -0.14 0.56 0.00 -0.00 -0.01 -0.01 0.04 0.17 0.30 0.37 -0.04 -0.05 -0.11 0.02 -0.00 0.00 0.00 0.00 0.02 0.00 0.01 -0.01 0.01 -0.23 0.24 -0.10 0.00 0.00 0.00 -0.05 0.05 0.02 0.02 -0.02 0.07 -0.00 -0.00 -0.00 0.08 -0.04 -0.03 -0.01 0.07 0.04 -0.00 -0.00 -0.00 0.04 0.01 0.03 0.01 0.03 -0.05 -0.00 -0.00 -0.00 -0.01 -0.01 -0.03 0.01 -0.01 -0.01 0.01 -0.01 0.00 0.04 -0.07 -0.04 -0.00 0.08 -0.12 -0.01 -0.01 0.01 0.09 -0.02 0.04 -0.06 0.03 -0.19 0.00 0.00 -0.00 0.06 -0.02 0.03 -0.02 -0.02 -0.01 -0.02 0.00 0.01 0.05 -0.08 -0.07 0.16 0.06 0.03 -0.00 0.00 -0.00 0.00 -0.02 0.02 -0.01 0.02 0.02 0.00 0.01 -0.00 -0.02 -0.02 -0.01 -0.08 -0.05 -0.02 -0.06 -0.02 -0.01 0.02 -0.03 0.03 -0.07 -0.03 -0.02 0.01 0.02 -0.06 0.08 -0.04 0.08 -0.03 0.08 -0.03 -0.01 -0.06 0.02 -0.21 0.01 0.29 -0.00 0.00 -0.01 0.04 -0.07 0.19 0.01 0.00 0.02 0.02 0.03 0.14 0.12 0.13 -0.03 0.14 -0.16 -0.13 0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.02 -0.01 -0.01 0.41 0.25 0.09 0.01 -0.01 -0.00 -0.08 0.04 0.03 0.10 0.03 0.04 0.00 0.00 -0.00 -0.08 0.04 0.04 -0.00 -0.06 -0.01 -0.01 -0.00 0.00 0.00 0.02 0.05 0.09 -0.03 -0.13 -0.00 0.00 0.00 -0.01 -0.03 -0.04 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.01 -0.00 -0.01 -0.01 -0.01 0.00 0.02 -0.01 0.01 -0.02 0.02 -0.05 0.00 0.00 0.01 0.05 -0.02 -0.04 -0.26 0.08 -0.40 0.03 0.00 -0.02 -0.09 0.13 0.10 -0.23 -0.10 -0.04 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.05 0.01 0.02 -0.04 0.02 -0.01 -0.08 -0.03 -0.02 0.00 -0.04 -0.04 -0.02 -0.00 0.05 0.07 0.01 -0.01 -0.01 0.04 0.02 -0.05 -0.04 -0.06 0.01 -0.04 0.00 0.02 -0.05 -0.04 0.01 -0.00 0.01 -0.21 0.37 -0.00 0.00 -0.00 -0.01 0.01 0.05 0.20 -0.17 -0.23 0.00 -0.11 -0.15 0.06 -0.00 -0.00 -0.00 0.01 0.02 0.01 -0.00 -0.01 -0.00 -0.01 0.33 -0.05 0.01 -0.00 0.01 -0.01 -0.00 0.01 -0.00 -0.02 0.02 0.01 0.01 -0.01 -0.29 0.13 0.27 0.06 -0.18 -0.18 -0.00 -0.00 -0.00 0.03 0.00 0.03 -0.03 0.06 -0.01 0.00 -0.00 0.00 -0.01 0.02 -0.01 0.03 -0.01 -0.01 -0.01 -0.00 -0.01 0.03 -0.12 -0.11 0.21 0.12 0.13 0.01 0.01 -0.01 -0.03 0.02 -0.02 0.03 -0.03 0.08 0.00 -0.00 -0.01 0.05 -0.04 0.18 0.07 0.02 0.06 -0.00 0.00 0.00 0.01 -0.01 -0.01 0.03 0.01 0.01 0.00 0.00 0.00 -0.09 0.03 -0.00 0.02 -0.06 -0.04 -0.00 0.00 -0.01 0.21 -0.01 0.11 -0.07 -0.02 -0.09 -0.13 0.03 0.06 0.00 0.00 0.01 0.01 0.01 -0.00 -0.01 0.00 0.00 -0.01 -0.01 -0.02 0.01 -0.01 0.02 -0.09 0.14 0.04 -0.02 0.01 0.04 -0.01 0.00 -0.01 0.12 -0.21 0.13 -0.00 0.01 0.00 0.06 -0.03 -0.14 0.16 0.18 -0.04 -0.01 0.07 0.02 0.00 -0.00 0.00 -0.04 -0.06 -0.10 -0.00 0.01 -0.00 0.01 -0.28 0.04 -0.00 0.00 -0.00 -0.02 -0.00 0.01 0.01 0.01 0.00 0.02 0.01 -0.01 -0.39 0.18 0.44 0.07 -0.20 -0.20 0.00 0.00 0.00 -0.05 -0.02 -0.07 -0.01 -0.06 0.07 -0.00 0.00 0.00 -0.00 -0.01 -0.02 -0.00 -0.02 -0.02 -0.00 0.01 0.01 -0.04 0.11 0.09 -0.08 -0.10 0.04 -0.01 -0.01 0.01 0.04 -0.01 0.02 -0.03 0.02 -0.09 -0.00 -0.01 -0.00 -0.08 0.02 0.07 0.09 0.07 0.03 0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.02 0.00 -0.01 -0.00 -0.00 0.00 0.07 -0.02 -0.01 0.02 0.04 0.01 -0.00 -0.01 -0.02 0.29 -0.03 0.15 0.01 0.05 -0.02 -0.05 0.09 0.15 -0.03 -0.08 -0.08 -0.05 -0.04 0.13 0.12 0.05 0.02 -0.01 0.12 0.03 -0.05 -0.08 -0.13 -0.07 0.04 0.05 0.00 -0.00 -0.01 -0.02 -0.00 0.00 0.21 -0.41 -0.26 -0.00 0.01 0.01 0.11 -0.04 -0.15 0.07 0.12 0.01 0.09 0.03 -0.07 0.00 0.00 0.00 -0.04 -0.06 -0.06 0.00 0.01 -0.01 -0.04 -0.29 0.02 0.01 -0.00 0.01 -0.08 0.05 0.04 0.09 0.02 0.08 -0.00 -0.01 0.01 0.07 -0.03 -0.24 -0.05 -0.03 0.10 -0.00 0.00 0.00 -0.01 0.01 0.00 0.12 -0.08 -0.12 0.00 0.00 -0.00 0.01 -0.04 -0.01 -0.04 -0.00 -0.00 0.01 0.03 0.01 -0.07 0.22 0.16 -0.26 -0.20 -0.08 -0.00 -0.01 0.00 -0.00 -0.02 0.02 -0.01 0.02 -0.02 0.00 -0.00 0.00 0.02 -0.00 -0.07 -0.11 0.01 -0.15 -0.00 0.00 -0.00 0.01 -0.01 -0.00 0.01 0.01 0.00 -0.01 -0.01 -0.00 0.13 -0.03 -0.02 -0.00 0.07 0.03 0.00 0.00 0.01 -0.09 0.00 -0.04 -0.06 -0.04 -0.18 0.05 -0.01 -0.03 -0.02 -0.01 0.02 -0.02 -0.07 0.00 -0.04 0.04 0.03 0.03 0.01 -0.02 0.05 0.02 -0.04 -0.05 -0.09 0.07 -0.01 -0.05 0.00 -0.01 0.00 -0.00 0.15 -0.27 -0.11 -0.00 -0.01 -0.02 -0.01 0.05 0.23 0.07 0.12 0.01 -0.15 -0.16 0.08 0.00 0.00 -0.00 -0.02 -0.03 -0.05 -0.00 -0.01 0.00 0.05 0.39 -0.04 0.01 0.00 0.01 0.25 -0.17 -0.07 -0.21 -0.03 -0.21 -0.00 -0.00 0.00 -0.00 0.00 -0.02 -0.00 -0.01 -0.01 0.00 -0.01 -0.00 0.10 0.04 0.12 -0.20 0.26 0.12 -0.01 -0.01 -0.00 -0.00 0.07 0.06 0.01 -0.00 -0.01 0.00 0.01 0.01 -0.05 0.12 0.09 -0.16 -0.12 -0.04 -0.00 -0.00 0.00 0.05 -0.01 0.03 -0.02 -0.02 -0.07 -0.00 0.01 -0.01 0.09 -0.04 0.15 0.13 -0.07 0.24 -0.00 0.00 -0.00 -0.02 0.01 -0.01 0.01 0.01 -0.00 -0.00 -0.00 0.00 0.08 -0.01 -0.02 0.00 0.03 0.01 0.00 0.01 -0.01 0.04 -0.01 0.02 0.11 -0.02 0.06 -0.11 -0.01 -0.01 0.00 0.01 -0.00 0.01 0.03 -0.00 -0.00 -0.01 -0.00 -0.01 -0.01 -0.01 -0.01 -0.02 0.03 -0.01 -0.24 0.08 -0.12 -0.13 0.13 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.02 -0.01 0.37 -0.00 -0.01 -0.00 -0.00 -0.00 -0.16 -0.23 0.09 -0.00 0.00 -0.01 -0.00 -0.00 -0.01 -0.01 0.01 -0.01 0.11 -0.36 0.07 0.01 -0.00 -0.00 -0.08 0.03 0.03 0.06 0.00 0.05 -0.00 -0.00 0.00 0.08 -0.04 -0.08 0.01 0.04 -0.02 -0.01 -0.01 -0.01 0.15 0.08 0.26 0.05 0.19 -0.26 0.00 0.00 0.00 -0.00 -0.02 -0.02 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.02 0.01 0.01 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 -0.01 0.22 -0.12 0.38 0.06 -0.04 0.12 0.01 0.00 -0.01 -0.08 0.07 0.02 -0.07 -0.03 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.01 0.02 -0.00 0.01 0.02 -0.00 -0.04 0.11 -0.09 -0.12 -0.05 -0.06 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 -0.01 -0.00 0.00 0.00 -0.01 -0.00 -0.00 0.37 -0.18 -0.28 -0.00 -0.02 0.00 -0.01 0.01 0.00 0.06 -0.10 0.04 0.00 0.01 -0.00 0.02 -0.00 -0.03 0.12 -0.02 -0.13 -0.00 0.00 0.00 -0.02 0.00 -0.00 0.18 0.13 0.42 0.00 0.00 -0.00 -0.01 -0.11 0.01 -0.00 0.00 0.00 0.11 -0.05 -0.04 -0.05 0.02 -0.10 0.01 0.00 -0.00 -0.06 0.03 0.06 0.01 -0.04 -0.02 0.01 -0.00 -0.00 -0.09 0.03 0.01 -0.08 0.01 0.13 -0.00 0.01 -0.01 0.05 -0.08 0.11 -0.13 0.22 0.27 0.01 0.00 -0.00 -0.03 0.08 0.05 0.00 -0.08 0.10 -0.00 -0.01 0.01 -0.04 0.16 -0.16 -0.01 0.02 -0.04 0.00 -0.00 -0.00 0.04 -0.02 0.05 -0.02 0.00 -0.04 0.00 -0.00 0.00 -0.03 0.01 -0.02 0.01 0.01 -0.00 0.00 -0.01 -0.00 -0.19 0.14 -0.13 0.02 -0.24 -0.13 -0.01 0.01 0.00 -0.06 0.01 -0.02 -0.01 -0.03 0.02 0.02 0.00 -0.00 -0.02 0.00 -0.00 0.01 -0.03 -0.01 -0.04 0.03 0.04 -0.00 0.01 -0.04 0.07 -0.01 -0.01 0.08 -0.02 -0.07 0.02 -0.01 -0.03 -0.00 0.00 0.00 0.05 -0.09 -0.03 -0.01 -0.00 -0.00 -0.06 0.02 0.09 0.05 -0.01 -0.06 -0.03 -0.02 0.01 -0.00 -0.00 -0.00 0.04 0.01 0.10 -0.00 -0.01 0.01 -0.00 0.32 -0.04 -0.02 -0.00 -0.02 -0.31 0.28 0.07 0.32 0.07 0.28 0.00 -0.00 0.00 -0.04 0.02 0.01 0.02 -0.04 -0.04 -0.01 0.01 0.01 -0.09 0.01 -0.02 0.34 -0.30 -0.32 0.01 0.01 0.00 0.01 -0.13 -0.09 -0.04 0.05 0.06 -0.00 0.00 0.00 -0.05 0.05 -0.01 -0.02 -0.05 0.04 -0.00 -0.01 0.00 -0.05 0.04 -0.05 -0.00 0.04 0.02 -0.01 0.00 -0.01 0.01 -0.01 0.06 0.12 -0.05 0.21 -0.00 0.00 0.00 -0.02 0.02 0.01 0.00 -0.02 0.01 0.00 -0.00 -0.00 -0.04 0.04 -0.04 0.00 -0.06 -0.03 -0.00 -0.00 0.01 -0.00 0.02 -0.00 0.08 0.05 -0.03 0.01 -0.01 -0.01 -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.01 -0.23 0.06 0.18 0.01 0.03 -0.01 0.00 0.01 -0.01 -0.06 0.13 0.23 0.00 -0.00 0.00 -0.08 -0.00 -0.02 0.13 -0.12 -0.20 0.06 0.06 -0.03 0.01 0.00 -0.01 -0.11 -0.20 -0.20 0.00 0.00 -0.00 -0.01 -0.03 -0.00 -0.00 -0.00 0.00 0.08 0.02 -0.04 -0.02 0.00 -0.03 -0.01 -0.01 0.03 0.12 -0.05 -0.25 0.13 -0.05 -0.29 -0.00 -0.00 -0.00 0.04 0.04 0.11 0.02 0.06 -0.09 -0.00 0.00 -0.00 0.01 -0.01 0.04 -0.02 0.06 0.08 -0.01 -0.01 -0.01 -0.18 0.19 -0.01 0.09 -0.21 0.37 -0.00 -0.00 0.01 0.00 0.14 -0.12 -0.02 -0.01 -0.07 -0.00 -0.00 0.00 -0.03 0.01 -0.04 0.01 0.00 0.01 0.00 -0.00 0.00 -0.01 0.01 0.00 -0.00 -0.01 0.00 0.00 0.00 0.02 0.02 0.12 -0.16 0.10 -0.17 -0.12 -0.01 0.01 0.01 0.04 0.07 0.01 0.02 -0.08 0.06 0.09 -0.02 -0.05 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.00 0.20 -0.14 -0.13 0.01 0.10 0.00 -0.00 0.00 -0.01 0.01 -0.01 0.03 0.00 -0.00 0.00 -0.07 -0.00 -0.02 0.02 0.03 -0.01 0.02 0.06 -0.00 -0.01 -0.01 0.00 0.10 0.38 0.12 -0.00 -0.00 -0.00 0.01 -0.03 0.01 0.00 -0.00 -0.00 0.01 0.06 -0.02 -0.06 -0.08 0.08 0.00 -0.01 0.02 -0.01 0.01 -0.16 0.13 -0.12 -0.28 -0.01 0.00 0.00 0.17 -0.08 -0.10 -0.01 0.06 -0.03 -0.00 -0.01 0.01 -0.04 0.10 -0.05 0.11 -0.17 -0.22 0.00 0.01 -0.01 -0.18 0.15 -0.10 0.06 -0.14 0.26 -0.00 0.01 0.00 0.07 -0.12 0.14 -0.01 -0.02 -0.04 -0.00 -0.00 -0.00 0.01 -0.01 0.04 -0.01 0.01 -0.02 -0.00 0.00 -0.00 0.08 -0.02 0.05 -0.03 -0.03 0.00 -0.00 -0.00 -0.02 -0.10 -0.18 0.27 -0.09 0.23 0.15 -0.01 0.01 0.01 0.00 0.08 -0.00 0.01 -0.06 0.04 0.06 -0.03 -0.05 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 0.02 0.00 -0.00 -0.03 -0.11 0.06 0.05 0.49 -0.02 -0.00 0.00 0.01 0.03 -0.05 -0.04 0.01 -0.01 0.01 -0.17 -0.03 -0.09 0.02 -0.02 -0.03 -0.05 0.17 0.09 -0.00 -0.00 -0.00 -0.01 0.05 -0.05 -0.01 -0.02 0.00 0.04 0.03 0.01 -0.00 0.02 -0.01 -0.21 -0.06 0.10 -0.08 -0.11 0.14 -0.00 0.00 -0.01 0.00 -0.00 0.05 -0.02 0.03 0.04 -0.01 -0.00 -0.01 0.23 0.01 0.12 -0.07 0.23 -0.09 0.01 0.00 -0.00 0.03 -0.09 0.00 -0.08 0.05 0.07 -0.00 -0.00 0.00 0.06 -0.05 0.03 -0.01 0.05 -0.07 0.00 -0.01 0.00 -0.04 0.07 -0.08 0.00 0.01 0.01 0.00 -0.01 -0.00 0.04 -0.03 0.11 -0.06 0.05 -0.14 -0.01 0.00 -0.01 0.46 -0.22 0.16 -0.03 0.01 -0.01 0.00 -0.00 0.01 -0.03 0.04 -0.05 0.05 -0.07 -0.06 0.00 0.00 -0.00 0.04 -0.06 0.03 -0.00 0.06 -0.06 -0.00 0.05 0.07 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.10 -0.16 -0.05 0.04 0.13 -0.04 0.00 -0.00 -0.00 -0.03 0.06 0.03 0.00 -0.00 0.00 -0.18 -0.01 -0.06 -0.05 0.05 0.08 0.07 0.15 -0.02 0.00 0.01 -0.01 0.04 -0.33 0.21 0.00 -0.00 0.00 -0.03 -0.01 -0.01 -0.01 -0.00 0.01 0.07 -0.11 -0.00 0.07 0.14 -0.19 0.00 0.00 0.00 -0.02 0.01 0.01 0.03 -0.02 -0.07 0.01 -0.01 -0.01 -0.33 0.29 0.49 0.11 -0.01 -0.17 -0.00 -0.00 0.00 -0.02 0.02 -0.04 0.04 -0.06 -0.08 -0.00 -0.00 -0.00 -0.01 0.01 0.01 -0.02 -0.01 -0.01 0.00 0.00 -0.01 0.02 -0.10 0.10 0.01 0.00 0.02 -0.01 -0.01 -0.00 0.01 -0.01 0.06 0.00 0.02 -0.02 -0.00 -0.01 0.00 0.02 -0.04 -0.04 0.04 0.06 -0.01 0.00 0.01 -0.02 0.10 -0.07 0.05 -0.13 0.13 0.12 -0.01 0.01 -0.00 0.04 -0.05 0.03 0.01 -0.06 0.05 0.08 0.09 0.10 -0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.01 0.00 0.01 -0.00 0.00 -0.00 0.02 -0.00 -0.00 0.01 -0.04 0.01 -0.01 0.00 0.02 0.00 0.00 -0.00 -0.05 0.10 0.10 0.00 0.00 -0.01 0.12 0.01 0.02 0.04 -0.09 -0.10 -0.19 -0.06 0.15 0.01 0.01 0.00 0.00 -0.21 0.07 -0.01 -0.00 -0.00 0.02 0.02 0.00 0.01 0.00 0.00 -0.28 -0.04 0.14 0.13 0.04 0.09 -0.00 -0.00 0.00 0.04 -0.02 -0.02 -0.01 0.03 0.03 0.02 -0.01 -0.02 -0.30 0.03 -0.07 -0.27 -0.03 0.46 0.01 0.00 0.01 -0.02 -0.13 -0.17 -0.00 -0.08 -0.09 -0.01 -0.00 -0.02 -0.03 0.11 0.11 0.00 -0.13 0.15 -0.00 0.00 0.00 -0.01 0.02 -0.02 -0.00 0.02 0.01 0.01 0.00 0.00 0.04 -0.02 0.03 -0.07 0.02 -0.11 -0.00 0.00 -0.00 0.12 -0.07 0.02 0.01 0.03 -0.01 -0.00 0.01 -0.01 0.12 -0.06 0.03 -0.07 0.10 0.08 0.00 0.00 -0.00 -0.07 0.09 -0.06 -0.02 0.12 -0.12 -0.11 -0.13 -0.16 0.00 -0.00 0.01 -0.00 -0.00 0.00 0.00 -0.01 -0.01 -0.00 0.00 -0.00 -0.00 0.01 -0.01 0.06 0.09 -0.08 -0.02 0.04 0.02 0.01 0.00 -0.00 -0.10 0.20 0.18 -0.01 0.01 0.00 0.13 0.01 0.07 0.05 -0.14 -0.13 0.14 -0.18 -0.16 -0.01 -0.01 0.00 0.02 0.13 0.02 -0.01 -0.00 -0.00 0.03 -0.02 0.01 -0.00 0.02 0.00 -0.03 -0.30 0.08 -0.10 0.02 -0.16 -0.00 0.01 -0.02 0.01 -0.01 0.15 -0.11 0.10 0.24 -0.01 0.01 0.02 0.09 -0.05 -0.06 0.18 -0.09 -0.21 0.00 -0.00 0.01 -0.01 -0.02 -0.04 -0.00 -0.07 -0.08 -0.01 -0.01 -0.03 0.08 0.16 0.36 -0.06 -0.20 0.14 -0.00 0.00 0.01 -0.00 0.06 -0.05 -0.01 -0.00 -0.02 -0.01 0.01 -0.00 -0.01 0.01 -0.03 0.07 -0.06 0.17 -0.01 0.00 -0.01 0.18 -0.10 0.03 0.02 0.05 -0.01 -0.01 -0.00 -0.00 0.14 -0.05 -0.00 -0.02 0.09 0.05 0.01 -0.00 -0.00 -0.10 -0.12 -0.03 0.02 -0.03 0.03 -0.02 0.05 0.08 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.03 0.07 -0.06 -0.02 -0.23 0.01 -0.01 0.00 0.01 0.03 -0.06 -0.03 -0.01 -0.01 0.01 0.06 -0.02 -0.02 0.07 -0.09 -0.13 0.21 -0.04 -0.18 -0.01 -0.01 -0.01 0.01 0.04 0.02 0.00 0.01 0.00 -0.01 0.07 -0.01 0.02 -0.00 -0.00 -0.20 0.09 0.08 0.08 -0.04 0.17 0.00 0.00 -0.01 -0.04 0.02 0.06 -0.03 0.00 0.06 -0.00 -0.02 -0.02 0.13 0.11 0.30 -0.26 0.41 0.06 0.00 0.00 0.01 -0.02 -0.10 -0.16 0.01 -0.06 -0.06 -0.00 0.00 -0.00 0.02 -0.03 -0.01 0.05 0.02 0.04 -0.00 -0.00 0.01 -0.02 0.07 -0.07 -0.01 0.01 -0.01 -0.01 0.00 0.00 -0.16 0.09 -0.26 0.07 -0.02 0.12 0.00 0.00 0.00 -0.12 0.07 -0.03 0.00 -0.01 0.00 0.00 0.00 -0.00 -0.05 -0.03 0.06 -0.01 0.03 0.02 -0.00 -0.01 0.00 -0.05 -0.08 -0.01 0.00 0.06 -0.03 0.29 0.16 0.18 0.00 -0.00 0.00 -0.01 -0.01 0.01 0.00 -0.00 -0.00 -0.01 0.01 -0.01 0.02 0.00 -0.00 0.04 -0.07 -0.01 0.01 -0.08 -0.02 0.02 -0.01 -0.01 -0.14 0.28 0.19 0.01 -0.01 -0.00 -0.19 -0.01 -0.06 -0.11 0.06 0.14 -0.14 0.22 0.17 -0.01 0.00 0.00 0.01 0.03 0.03 0.01 0.01 0.00 -0.03 0.00 -0.01 0.01 -0.01 -0.01 0.05 0.31 -0.09 0.03 -0.10 0.21 0.00 0.00 -0.01 -0.02 0.01 0.10 -0.09 0.05 0.20 -0.01 -0.00 -0.01 0.16 -0.02 0.02 -0.07 0.15 -0.01 -0.00 -0.00 -0.01 0.02 0.07 0.12 -0.02 0.05 0.05 0.00 -0.01 -0.01 -0.02 0.19 0.25 -0.17 -0.20 0.00 0.00 0.00 -0.01 0.02 -0.09 0.08 0.01 -0.01 0.02 0.01 -0.01 0.00 0.03 -0.02 0.06 -0.07 0.04 -0.15 0.01 -0.00 0.01 -0.25 0.14 -0.05 -0.02 -0.06 0.02 -0.01 -0.01 0.00 0.18 0.01 -0.10 -0.00 0.01 0.01 0.01 0.00 -0.00 -0.06 -0.11 -0.01 0.01 -0.05 0.01 -0.03 0.06 0.08 -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 0.00 0.04 0.05 -0.05 -0.02 0.13 0.03 0.01 -0.01 -0.01 -0.07 0.13 0.07 -0.01 0.01 0.01 0.19 0.03 0.12 -0.17 0.22 0.30 0.23 -0.28 -0.25 -0.00 0.01 -0.00 0.01 -0.18 0.11 -0.01 -0.01 -0.01 0.05 -0.06 0.02 -0.00 -0.00 -0.01 -0.03 0.18 -0.04 -0.04 -0.12 0.19 0.00 -0.00 0.01 -0.00 0.00 -0.05 0.06 -0.04 -0.13 0.01 -0.00 -0.01 -0.06 0.01 -0.02 -0.09 0.04 0.13 -0.00 0.00 -0.02 0.04 0.05 0.16 -0.07 0.12 0.14 0.00 -0.01 0.01 -0.08 0.07 -0.02 -0.10 -0.05 -0.07 0.00 -0.00 -0.01 0.02 -0.17 0.15 0.02 -0.00 0.06 -0.01 0.01 -0.00 -0.05 0.03 -0.10 0.10 -0.07 0.21 -0.00 0.01 -0.00 0.26 -0.10 0.12 -0.06 -0.05 0.00 0.00 -0.00 0.00 0.06 0.04 -0.08 -0.01 -0.04 -0.01 -0.01 0.00 0.00 0.02 0.05 0.00 0.02 -0.05 0.06 0.05 -0.01 -0.02 0.00 -0.01 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.01 0.01 -0.01 -0.00 0.00 0.01 0.00 -0.01 0.00 0.01 0.20 0.00 -0.01 0.01 0.01 0.05 -0.10 -0.05 0.00 0.01 -0.00 -0.03 0.04 0.11 0.16 -0.23 -0.30 0.06 -0.10 -0.07 0.00 0.01 0.00 -0.01 -0.21 0.06 -0.00 -0.00 -0.01 0.02 -0.11 0.01 -0.01 -0.02 -0.01 0.20 0.38 -0.18 -0.04 -0.13 0.19 0.00 0.00 -0.01 -0.05 0.02 0.07 -0.10 0.02 0.22 0.01 0.00 -0.01 -0.10 0.02 -0.00 -0.01 -0.04 0.06 -0.01 -0.02 0.01 -0.02 0.24 0.15 0.10 -0.13 -0.15 -0.00 0.00 -0.00 0.02 -0.07 -0.09 0.09 0.07 0.03 -0.00 0.00 0.02 0.03 0.15 -0.12 -0.02 -0.04 -0.10 -0.00 0.00 -0.00 0.05 -0.02 0.06 0.02 -0.03 0.05 0.00 0.00 0.00 0.06 0.00 0.07 -0.06 -0.08 0.01 0.00 0.01 -0.01 0.04 -0.04 0.05 -0.06 0.06 0.06 0.01 0.00 -0.00 -0.07 -0.08 -0.03 0.03 -0.12 0.12 -0.12 -0.01 0.01 -0.01 0.01 -0.02 0.02 0.03 -0.01 -0.03 0.01 0.02 0.03 -0.02 0.03 -0.02 -0.04 -0.01 0.04 0.18 -0.10 -0.00 -0.09 -0.00 -0.00 0.00 -0.00 0.02 -0.03 -0.01 -0.01 -0.01 -0.00 0.30 -0.08 -0.24 0.03 -0.01 -0.04 -0.19 0.05 0.16 -0.01 -0.00 -0.00 0.01 -0.18 0.10 -0.01 -0.01 0.01 0.01 0.26 -0.02 0.00 -0.00 -0.01 0.11 0.00 -0.06 -0.17 -0.13 0.02 0.00 -0.00 0.00 -0.04 0.02 0.04 -0.01 -0.02 0.02 0.00 0.00 0.01 0.02 0.03 0.06 0.11 -0.01 -0.15 -0.01 -0.01 -0.01 0.03 0.24 0.29 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.04 0.03 -0.03 0.05 -0.04 0.12 0.00 0.00 0.00 0.05 -0.03 0.05 -0.01 -0.03 -0.05 0.01 -0.00 0.01 -0.08 0.04 -0.14 -0.04 0.03 -0.09 -0.00 0.01 -0.00 0.12 -0.04 0.06 -0.02 -0.03 0.01 0.00 0.00 -0.00 0.03 -0.01 -0.00 -0.03 0.02 0.02 0.00 -0.01 0.01 -0.13 0.01 -0.06 -0.08 0.35 -0.32 0.14 0.01 0.00 0.07 0.01 0.08 -0.09 -0.13 0.04 0.12 -0.05 -0.09 -0.11 0.08 -0.12 0.06 0.11 0.15 -0.05 0.30 -0.06 -0.02 -0.06 0.02 -0.01 -0.00 -0.01 0.04 -0.10 -0.06 -0.00 -0.00 -0.01 0.16 -0.00 0.02 -0.03 0.11 0.08 -0.25 -0.05 0.19 0.00 -0.02 -0.00 -0.02 0.01 -0.07 -0.00 -0.00 -0.00 0.03 0.07 -0.00 -0.01 0.00 -0.01 -0.00 -0.04 -0.00 -0.02 0.00 -0.04 0.00 0.00 -0.00 -0.02 0.01 0.03 -0.02 0.00 0.05 0.00 -0.01 0.00 -0.10 0.10 0.17 0.07 -0.01 -0.11 -0.00 -0.00 -0.01 0.02 0.09 0.14 -0.02 0.08 0.09 -0.01 -0.00 -0.02 0.02 -0.04 -0.03 0.23 0.00 0.28 -0.00 0.01 -0.01 0.06 -0.17 0.18 -0.00 -0.00 -0.01 0.01 0.00 0.01 -0.05 0.03 -0.13 -0.04 0.01 -0.08 -0.01 0.00 -0.00 0.16 -0.07 0.06 -0.01 -0.00 -0.00 0.01 0.00 0.00 -0.30 0.01 0.12 0.04 -0.05 -0.04 0.01 -0.01 0.01 -0.17 -0.03 -0.08 -0.00 0.23 0.02 0.05 -0.02 -0.02 0.01 0.01 0.02 -0.02 -0.03 0.01 0.03 -0.01 -0.02 -0.02 0.02 -0.02 0.01 0.03 0.04 0.10 -0.21 -0.02 -0.03 -0.26 0.02 0.00 0.00 0.01 -0.02 0.05 0.03 -0.00 -0.00 0.00 0.00 -0.04 -0.13 0.03 -0.11 -0.09 0.07 0.10 -0.04 -0.01 0.02 0.00 0.03 -0.28 0.22 0.00 0.01 0.01 0.00 0.10 -0.01 0.01 0.01 -0.01 -0.05 -0.10 0.04 -0.17 -0.13 0.06 -0.01 -0.00 0.01 0.06 -0.03 -0.09 0.11 -0.02 -0.24 -0.00 0.01 0.01 0.19 -0.13 -0.22 0.05 -0.03 -0.05 0.00 -0.00 0.01 -0.01 0.03 0.01 0.00 -0.08 -0.09 -0.01 -0.00 0.02 0.04 -0.07 0.00 -0.15 0.10 -0.29 0.00 -0.00 0.01 -0.04 0.17 -0.18 -0.00 -0.01 -0.01 -0.00 -0.00 -0.00 -0.01 0.00 0.01 0.02 0.01 0.01 -0.00 0.01 -0.00 0.04 -0.01 0.02 -0.00 -0.01 0.00 -0.01 0.00 -0.01 0.33 -0.02 -0.12 -0.09 0.07 0.07 -0.02 -0.00 0.00 0.19 0.12 0.08 0.00 0.08 -0.00 0.09 0.01 -0.01 -0.00 -0.01 0.00 0.01 0.01 -0.01 -0.02 0.01 0.01 0.01 -0.00 0.01 0.01 -0.00 -0.03 0.05 0.32 -0.15 -0.07 -0.32 0.06 -0.00 -0.00 -0.00 0.02 -0.05 -0.04 0.01 0.00 -0.02 -0.24 0.09 0.34 -0.01 0.03 0.02 -0.24 -0.03 0.19 -0.01 0.00 -0.00 0.00 -0.28 0.15 0.01 0.02 -0.01 0.02 -0.26 0.03 0.00 0.01 -0.00 -0.11 -0.11 0.07 -0.10 -0.09 0.07 0.00 0.00 0.00 -0.03 0.02 0.02 0.02 -0.03 -0.05 -0.00 -0.00 0.01 0.15 -0.03 -0.00 0.06 0.08 -0.15 0.00 0.00 0.00 0.00 -0.07 -0.06 -0.03 0.01 0.01 -0.00 0.00 -0.00 -0.00 -0.04 -0.06 0.08 0.04 0.05 -0.00 -0.00 -0.00 0.00 -0.03 0.03 0.00 0.01 0.01 0.01 -0.00 0.01 -0.03 0.02 -0.08 -0.05 0.03 -0.10 -0.00 0.01 -0.01 0.16 -0.06 0.06 -0.02 -0.01 -0.00 0.00 0.01 -0.01 -0.01 -0.00 0.01 -0.04 0.01 0.02 0.00 0.00 0.01 -0.10 -0.06 -0.03 0.01 -0.28 0.15 -0.03 -0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 0.01 0.06 0.36 -0.17 0.03 0.28 -0.02 0.01 0.00 0.01 -0.06 0.13 0.08 0.00 0.00 -0.01 0.12 0.03 0.14 -0.01 -0.06 -0.01 -0.22 -0.14 0.15 -0.00 -0.02 -0.00 0.03 0.21 -0.02 -0.00 -0.01 -0.01 0.00 -0.05 0.00 -0.01 -0.01 0.01 0.15 0.11 -0.08 0.08 0.09 -0.09 0.00 -0.00 0.01 -0.03 0.01 -0.05 0.07 -0.06 -0.15 0.00 -0.01 0.00 -0.04 0.07 0.16 0.00 0.08 -0.07 -0.00 -0.00 0.01 -0.03 -0.06 -0.13 0.05 -0.07 -0.08 0.01 -0.00 0.02 -0.12 0.07 -0.09 -0.28 -0.01 -0.34 0.00 -0.01 0.00 -0.07 0.20 -0.21 0.01 -0.00 0.02 0.01 0.00 0.01 -0.07 0.04 -0.14 -0.03 0.02 -0.06 0.00 -0.01 0.00 -0.03 0.01 -0.01 -0.00 0.00 0.00 -0.01 -0.00 0.00 0.14 -0.01 -0.05 -0.01 0.01 0.01 -0.00 -0.01 0.01 -0.00 0.06 -0.01 -0.01 0.03 -0.03 0.04 -0.04 -0.05 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 0.04 0.08 -0.06 0.07 0.46 -0.06 -0.01 -0.00 -0.00 0.03 -0.06 -0.04 0.00 -0.00 0.00 0.08 -0.01 -0.02 -0.00 0.04 0.03 0.02 -0.07 -0.03 -0.01 0.02 0.00 -0.01 -0.36 0.17 -0.00 -0.02 0.00 -0.03 0.02 -0.01 0.01 0.00 0.01 0.05 -0.03 -0.00 0.01 0.05 -0.07 0.01 0.00 -0.00 -0.04 0.02 0.05 0.00 -0.02 -0.00 -0.01 0.00 0.01 0.32 -0.16 -0.19 -0.02 0.11 -0.06 0.00 0.01 0.00 -0.01 -0.21 -0.23 -0.02 0.03 0.03 -0.01 0.00 -0.00 -0.02 -0.04 -0.08 0.13 0.02 0.15 -0.00 0.00 -0.00 0.01 -0.10 0.10 0.00 0.03 0.03 0.00 0.00 -0.00 0.02 -0.01 0.01 0.00 -0.02 0.02 0.01 -0.02 0.01 -0.33 0.13 -0.13 0.03 0.03 -0.00 0.00 0.00 -0.00 0.10 0.00 -0.05 -0.04 0.02 0.03 0.01 -0.00 0.01 -0.17 -0.07 -0.08 -0.01 0.09 -0.05 -0.04 -0.02 -0.01 0.01 0.00 -0.01 -0.00 -0.00 0.00 -0.01 0.00 0.01 0.00 -0.00 0.00 0.01 0.00 -0.01 0.06 0.13 -0.10 0.03 0.25 -0.02 -0.01 0.00 0.00 0.03 -0.05 -0.04 0.00 0.00 -0.00 -0.04 0.05 0.18 0.05 -0.06 -0.09 -0.07 -0.11 0.03 -0.00 -0.01 -0.00 0.03 0.06 0.05 0.00 -0.01 -0.01 -0.02 -0.10 0.00 0.01 -0.00 -0.01 -0.19 -0.09 0.10 0.04 -0.02 0.06 -0.02 -0.00 0.00 0.17 -0.08 -0.09 0.03 0.08 -0.07 0.00 -0.00 -0.00 -0.02 0.03 0.05 -0.01 0.03 -0.01 -0.00 -0.01 -0.01 0.03 0.22 0.29 -0.01 0.02 0.02 -0.02 -0.01 -0.01 0.29 -0.11 0.32 0.10 0.07 0.06 -0.00 0.01 0.00 0.05 -0.09 0.10 -0.01 -0.02 -0.05 -0.00 -0.00 0.00 -0.06 0.03 -0.08 0.01 0.03 -0.01 0.01 -0.01 0.00 -0.25 0.10 -0.09 0.02 0.03 -0.00 -0.00 -0.00 -0.00 0.06 -0.01 -0.03 -0.01 0.02 0.01 -0.02 -0.01 -0.00 0.38 0.22 0.16 -0.02 0.00 -0.05 0.06 -0.03 -0.04 -0.01 0.01 -0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.02 0.17 -0.08 -0.00 -0.06 0.00 0.00 -0.00 -0.00 -0.01 0.02 0.02 -0.00 0.00 0.00 0.11 -0.04 -0.16 -0.01 0.02 0.03 -0.01 0.05 0.01 -0.00 -0.00 -0.01 0.01 -0.16 0.10 -0.00 -0.00 0.01 0.01 0.09 -0.01 -0.01 0.00 0.01 0.23 0.17 -0.13 -0.07 -0.04 0.01 -0.02 -0.01 -0.01 0.10 -0.05 -0.09 -0.13 0.10 0.26 -0.00 -0.00 0.00 0.05 -0.01 -0.00 0.01 0.04 -0.04 0.00 0.01 0.01 -0.03 -0.23 -0.30 0.01 0.00 -0.00 0.01 -0.00 -0.01 0.03 0.06 0.10 -0.01 -0.07 0.04 -0.00 -0.00 -0.00 -0.01 -0.02 0.01 0.00 0.03 0.03 -0.00 -0.00 0.00 -0.01 0.00 0.02 0.02 0.03 -0.01 -0.00 0.00 -0.00 0.10 -0.04 0.05 -0.02 -0.03 0.01 0.01 0.01 -0.01 -0.29 -0.02 0.16 -0.01 -0.01 -0.00 -0.01 -0.01 -0.01 0.49 0.23 0.21 0.02 -0.05 0.06 -0.05 -0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.05 -0.12 0.00 -0.02 -0.10 0.02 -0.01 0.00 0.01 0.03 -0.06 -0.05 -0.00 -0.00 -0.00 0.06 0.01 0.04 0.08 -0.12 -0.16 -0.10 -0.03 0.07 -0.00 -0.00 0.00 0.02 0.20 -0.03 -0.00 0.00 -0.00 0.02 -0.01 0.01 -0.02 -0.01 0.01 0.22 0.20 -0.14 0.12 0.13 -0.09 -0.00 0.00 -0.00 0.03 -0.01 -0.01 -0.00 0.02 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.01 -0.01 -0.01 0.01 -0.00 0.01 -0.01 0.00 -0.19 -0.16 -0.03 0.08 0.09 -0.02 -0.00 0.00 0.08 -0.12 -0.01 0.16 0.10 0.11 -0.01 0.01 -0.00 0.08 -0.26 0.28 -0.01 0.03 -0.01 0.00 -0.00 0.00 -0.05 0.03 -0.08 -0.01 0.02 -0.03 -0.01 0.01 -0.00 0.22 -0.09 0.08 -0.02 -0.02 0.00 -0.02 -0.01 0.01 0.47 0.03 -0.27 0.01 0.02 0.01 -0.01 0.00 -0.00 0.07 0.02 0.03 0.01 -0.01 0.02 0.13 0.06 0.06 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 -0.00 0.05 0.43 -0.18 0.00 -0.09 -0.01 -0.00 0.00 0.00 0.02 -0.03 -0.03 -0.00 0.00 0.01 0.02 -0.08 -0.33 0.02 -0.03 -0.04 0.20 0.17 -0.13 -0.00 -0.02 0.00 0.02 0.11 -0.01 -0.00 -0.00 0.01 -0.01 0.15 -0.01 0.00 0.00 -0.00 -0.05 0.01 0.02 -0.01 -0.04 0.07 -0.00 0.00 0.01 0.02 -0.00 0.01 0.08 -0.02 -0.16 0.00 -0.01 -0.00 -0.04 0.07 0.14 -0.05 0.11 -0.00 0.00 0.00 -0.00 0.01 -0.01 0.01 -0.02 0.02 0.02 -0.01 -0.00 0.00 0.11 -0.08 0.08 0.06 0.07 0.01 -0.00 0.00 -0.00 0.02 -0.05 0.05 -0.00 0.00 -0.01 -0.00 0.00 -0.01 0.14 -0.08 0.23 0.00 -0.04 0.04 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 -0.01 0.00 0.19 0.01 -0.10 0.00 0.01 0.01 0.01 -0.00 0.01 -0.11 -0.01 -0.05 0.05 -0.12 0.14 -0.38 -0.21 -0.20 -0.00 -0.01 0.01 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 -0.01 0.06 -0.02 0.00 -0.01 -0.00 0.00 0.01 0.01 -0.05 0.10 0.05 0.00 -0.00 0.00 -0.05 -0.00 -0.00 0.15 -0.34 -0.35 0.05 0.02 -0.03 -0.00 0.00 -0.00 -0.00 -0.06 0.02 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.13 -0.13 0.08 0.04 0.04 -0.04 0.00 -0.01 0.00 -0.06 0.02 -0.03 -0.06 -0.01 0.12 -0.00 -0.00 0.00 0.05 -0.02 -0.01 -0.02 0.04 -0.00 -0.00 0.00 -0.02 0.03 0.03 0.10 -0.04 0.10 0.11 0.03 0.00 0.02 -0.25 0.11 -0.26 -0.26 -0.05 -0.28 -0.01 0.02 0.00 0.13 -0.33 0.37 -0.02 0.00 -0.06 -0.00 -0.00 -0.00 0.02 -0.01 0.03 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.03 0.01 -0.02 0.01 0.02 -0.00 0.01 0.00 -0.00 -0.14 0.02 0.05 0.01 -0.04 -0.02 0.00 -0.00 -0.00 0.06 0.03 0.03 -0.00 0.02 -0.01 -0.06 -0.02 -0.02 0.00 0.02 -0.01 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.05 -0.09 0.08 0.00 0.03 -0.00 0.00 0.00 0.01 -0.02 0.04 0.01 -0.00 0.00 -0.00 0.09 -0.00 -0.01 0.06 -0.15 -0.15 -0.07 -0.03 0.05 0.00 0.00 -0.00 -0.02 -0.08 -0.03 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 0.14 0.12 -0.08 -0.11 -0.10 0.08 -0.00 0.01 0.01 0.03 -0.01 0.06 0.18 -0.04 -0.37 0.00 0.00 -0.00 -0.05 0.01 -0.01 0.03 -0.06 0.00 0.00 0.01 -0.00 -0.01 -0.13 -0.15 -0.00 0.03 0.04 -0.01 -0.01 -0.00 0.31 -0.05 0.43 -0.13 0.04 -0.22 -0.00 0.01 -0.00 0.04 -0.13 0.14 -0.01 0.02 -0.01 0.00 0.00 0.00 -0.01 0.01 -0.04 -0.01 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.01 0.01 -0.02 -0.02 0.00 0.01 0.00 -0.00 -0.32 -0.01 0.16 0.02 -0.02 -0.01 0.00 0.01 0.00 -0.25 -0.12 -0.11 0.01 -0.05 0.03 0.07 0.03 0.03 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 0.02 -0.01 -0.01 -0.07 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.09 -0.03 -0.10 -0.01 0.01 0.01 -0.02 0.03 0.02 -0.01 0.01 -0.00 -0.01 -0.16 0.07 -0.00 -0.00 0.00 0.01 0.05 -0.00 -0.03 -0.02 0.01 -0.02 0.11 -0.02 0.53 0.45 -0.25 -0.00 0.00 0.00 0.01 -0.01 0.01 0.03 -0.00 -0.07 -0.02 -0.01 0.01 0.27 -0.13 -0.12 -0.11 0.16 0.02 -0.00 -0.01 -0.00 0.01 0.21 0.22 0.06 -0.03 -0.04 -0.00 -0.00 -0.00 0.09 -0.01 0.12 -0.02 0.01 -0.04 0.00 -0.00 0.00 -0.01 0.05 -0.05 -0.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.01 -0.01 0.00 -0.00 0.19 -0.09 0.05 0.01 0.03 -0.01 0.01 0.01 -0.00 -0.14 -0.01 0.09 -0.02 0.00 0.01 -0.00 0.00 0.00 -0.02 -0.03 -0.01 0.02 -0.13 0.09 0.00 0.01 0.01 -0.33 0.58 -0.42 -0.06 -0.15 0.07 0.11 -0.08 -0.03 0.10 -0.09 0.12 0.04 -0.00 0.09 0.01 0.02 -0.01 -0.01 -0.03 0.01 0.00 0.00 0.00 0.01 -0.03 -0.03 0.01 -0.00 -0.01 -0.18 0.04 0.15 0.00 0.01 0.01 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.01 0.00 0.01 0.00 -0.02 -0.19 0.01 -0.00 -0.00 -0.00 -0.07 -0.01 0.03 0.10 0.07 -0.01 -0.00 -0.02 -0.00 -0.02 0.01 0.13 -0.02 0.07 0.06 -0.00 -0.00 -0.00 0.04 -0.02 -0.01 -0.01 0.03 -0.00 -0.00 -0.00 -0.00 0.01 0.06 0.07 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.08 0.00 -0.11 0.02 -0.00 0.03 0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.00 -0.01 -0.01 0.01 -0.01 -0.01 -0.02 0.01 0.04 0.06 -0.00 0.10 -0.00 0.00 -0.00 0.03 -0.01 0.01 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.04 0.00 -0.02 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.01 -0.00 0.18 0.14 0.20 -0.03 -0.01 0.00 0.05 0.01 -0.01 -0.01 -0.01 0.00 -0.02 0.01 0.01 -0.01 0.00 -0.00 -0.00 -0.02 0.01 0.01 0.10 -0.04 -0.02 -0.12 0.02 0.00 -0.00 -0.00 -0.01 0.01 0.01 0.01 -0.01 0.01 -0.45 0.07 0.25 -0.00 -0.00 -0.00 0.23 0.03 -0.17 -0.00 -0.00 -0.00 0.00 -0.03 0.02 0.01 0.01 -0.01 -0.00 -0.15 0.01 -0.01 -0.01 0.01 0.16 0.11 -0.10 0.05 0.08 -0.10 -0.00 0.00 0.00 0.02 -0.01 -0.00 0.02 0.00 -0.05 -0.00 -0.00 0.00 0.06 -0.02 -0.00 -0.03 0.05 0.00 -0.00 0.00 0.00 -0.01 -0.03 -0.04 0.02 -0.00 -0.01 -0.00 -0.00 -0.00 0.06 0.00 0.10 -0.02 -0.02 -0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.00 0.05 -0.03 0.09 0.02 -0.03 0.05 -0.00 0.00 -0.00 0.10 -0.04 0.04 -0.01 -0.01 0.00 0.00 0.00 -0.00 -0.05 -0.00 0.03 -0.00 0.00 0.00 0.01 -0.01 0.01 -0.02 0.06 -0.02 -0.13 0.47 -0.44 -0.13 -0.10 -0.11 0.48 0.15 -0.22 -0.08 -0.10 0.04 -0.13 0.04 0.09 -0.03 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.03 0.01 0.00 0.04 0.00 -0.01 -0.00 -0.00 -0.02 0.05 0.06 -0.01 0.01 0.01 0.23 -0.04 -0.16 -0.01 -0.01 -0.00 0.01 -0.01 -0.01 0.00 0.00 0.00 -0.00 0.02 -0.01 -0.00 -0.00 0.01 -0.01 -0.01 -0.01 0.00 0.00 0.00 -0.03 -0.06 0.03 -0.04 -0.03 -0.01 0.00 -0.00 -0.00 -0.02 0.01 -0.01 -0.03 0.01 0.06 0.00 0.00 -0.00 -0.02 0.01 -0.00 -0.00 -0.01 0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.10 0.00 -0.17 0.03 0.05 -0.02 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.01 0.00 -0.01 -0.01 0.01 -0.03 0.00 -0.00 -0.00 -0.02 0.01 -0.01 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.05 0.01 -0.03 0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.02 -0.04 0.02 -0.35 -0.61 -0.11 0.02 0.04 0.05 0.16 0.54 0.61 -0.03 -0.06 -0.01 0.05 -0.05 -0.06 -0.01 -0.02 -0.04 -0.11 -0.23 -0.30 0.00 -0.01 0.00 -0.01 0.02 0.01 0.01 0.00 -0.00 -0.00 -0.02 -0.02 -0.01 0.00 0.01 0.00 -0.00 0.01 0.00 0.01 0.00 -0.03 -0.01 0.01 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.01 -0.01 -0.00 -0.01 -0.08 0.01 0.07 0.11 0.01 0.14 0.00 0.00 0.00 -0.02 0.00 -0.02 -0.02 0.01 0.03 -0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.01 0.02 0.02 0.00 -0.00 -0.00 -0.01 -0.00 0.01 -0.03 0.02 -0.11 -0.00 -0.01 0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 -0.02 0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.02 -0.00 0.26 0.06 0.05 0.01 0.00 0.01 0.09 -0.03 -0.06 -0.00 0.00 0.00 -0.01 0.00 0.01 -0.00 0.00 0.01 -0.07 -0.02 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.01 0.00 -0.00 -0.01 -0.05 0.01 0.04 -0.00 -0.00 0.00 -0.06 -0.01 0.04 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.02 0.00 -0.00 0.00 -0.00 -0.02 -0.02 0.01 0.03 0.00 0.04 0.00 0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.02 -0.03 0.01 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.01 0.01 -0.02 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.02 -0.01 0.61 0.53 0.55 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.02 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 0.01 -0.00 0.03 -0.06 -0.00 0.03 -0.01 0.06 -0.00 0.00 -0.00 0.01 -0.01 0.01 -0.00 -0.02 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.04 0.03 -0.02 0.19 -0.45 0.35 0.49 0.01 -0.06 0.00 0.01 -0.00 0.04 -0.07 -0.03 -0.05 -0.07 0.03 -0.01 -0.01 -0.01 0.22 0.07 -0.01 0.01 0.13 0.13 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 0.03 -0.01 0.17 -0.24 0.26 -0.04 -0.32 -0.13 -0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.02 -0.01 0.02 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.01 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.00 -0.01 -0.00 -0.00 -0.00 0.04 0.01 -0.02 0.01 -0.02 0.04 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 0.00 0.01 0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.02 -0.05 -0.03 -0.04 0.36 0.68 0.30 0.54 -0.10 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.01 0.01 -0.00 -0.01 -0.01 -0.02 0.02 -0.12 0.19 -0.22 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.25 0.21 -0.08 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 0.00 0.01 -0.00 0.00 0.00 -0.00 0.00 -0.01 0.01 0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 -0.01 0.01 -0.01 0.00 0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 -0.01 0.00 -0.05 0.13 -0.06 -0.11 -0.01 0.01 -0.00 -0.01 -0.00 -0.03 0.04 0.02 0.03 0.04 -0.02 -0.04 -0.03 -0.02 0.64 0.18 -0.02 0.03 0.38 0.36 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.01 0.00 0.00 -0.01 0.00 -0.06 0.08 -0.09 0.01 0.11 0.04 0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.02 -0.01 -0.01 0.01 -0.01 -0.02 -0.00 -0.00 0.00 -0.02 0.02 -0.03 0.00 0.00 0.00 -0.03 -0.01 -0.03 0.03 0.03 -0.01 -0.01 -0.04 -0.00 -0.00 0.00 0.00 -0.01 -0.01 -0.02 -0.00 0.00 0.00 0.02 -0.00 0.01 -0.00 0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.00 0.01 -0.00 -0.00 0.00 0.01 -0.01 -0.01 0.00 -0.01 -0.01 -0.00 0.00 -0.01 0.07 0.01 0.06 0.01 -0.07 0.05 -0.00 0.00 -0.00 0.01 -0.01 0.01 0.01 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.02 0.01 0.01 0.02 -0.01 0.00 0.00 0.00 -0.03 -0.01 0.00 -0.00 -0.02 -0.02 -0.05 -0.02 0.02 0.43 -0.17 -0.29 0.33 0.44 -0.04 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.02 -0.03 -0.01 -0.12 0.41 -0.16 -0.01 -0.02 0.00 -0.20 0.16 0.29 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.05 0.03 -0.23 0.36 -0.41 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.48 0.42 -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.00 0.01 0.00 -0.00 0.00 -0.02 0.01 -0.01 0.01 0.03 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 0.03 -0.08 0.04 0.07 0.00 -0.01 -0.00 -0.00 -0.00 -0.02 0.04 0.02 0.02 0.03 -0.02 0.02 0.01 0.01 -0.33 -0.09 0.00 -0.02 -0.19 -0.20 0.00 0.00 -0.00 -0.04 0.02 0.03 -0.03 -0.04 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 0.03 -0.05 0.05 -0.01 -0.06 -0.02 -0.00 0.00 0.00 0.01 -0.02 0.01 0.00 0.00 0.00 0.01 -0.01 -0.02 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.39 0.11 0.63 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.02 0.00 0.02 0.00 0.00 -0.00 0.01 0.03 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.06 -0.01 -0.02 -0.62 0.07 -0.21 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 0.00 0.01 0.01 -0.00 -0.00 0.00 0.02 -0.01 -0.01 0.02 0.02 -0.00 0.00 0.00 -0.00 0.02 -0.01 -0.02 -0.04 -0.02 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.08 -0.02 -0.06 -0.01 0.00 0.01 0.00 0.00 -0.00 0.01 -0.02 0.02 0.00 0.00 0.00 -0.03 -0.01 -0.03 -0.02 -0.02 0.01 -0.01 -0.04 0.00 -0.00 0.00 0.01 -0.05 -0.03 -0.09 0.00 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.00 -0.00 0.02 -0.03 -0.01 0.02 -0.00 0.03 0.00 -0.01 0.01 -0.10 0.05 -0.08 0.04 0.15 -0.03 -0.01 0.01 -0.01 0.13 0.02 0.10 0.01 -0.13 0.09 -0.00 0.00 -0.00 0.01 -0.03 0.02 0.04 -0.00 -0.01 -0.00 -0.01 -0.00 -0.04 0.08 0.05 0.06 0.08 -0.03 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.04 0.01 -0.02 -0.33 0.14 0.22 -0.25 -0.34 0.03 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 0.02 -0.02 0.01 0.03 0.01 0.02 -0.04 -0.01 -0.11 0.49 -0.18 -0.00 -0.02 0.01 -0.22 0.20 0.35 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.51 0.14 0.38 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.02 0.01 0.00 0.00 0.00 -0.01 -0.00 -0.01 -0.02 -0.01 0.00 -0.00 -0.01 0.00 0.01 -0.02 -0.06 0.28 0.18 0.60 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.02 -0.03 -0.00 0.01 -0.00 0.03 0.00 -0.01 0.00 -0.10 0.05 -0.05 0.03 0.13 -0.01 -0.00 0.00 -0.00 0.05 0.01 0.04 0.00 -0.06 0.04 -0.01 0.00 -0.00 0.04 -0.09 0.06 0.10 -0.01 -0.02 -0.00 -0.01 -0.00 -0.04 0.07 0.04 0.05 0.08 -0.03 0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.01 0.01 0.01 -0.01 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 -0.02 0.05 -0.08 -0.01 0.09 0.05 0.00 -0.00 -0.00 -0.02 0.02 -0.02 0.00 0.00 -0.00 -0.02 0.01 0.02 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.13 -0.04 -0.10 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.03 -0.04 0.02 -0.00 -0.00 -0.00 0.01 0.00 0.01 -0.04 -0.03 0.01 0.00 0.02 -0.00 -0.00 0.01 0.01 -0.07 -0.05 -0.16 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.00 0.01 0.02 -0.04 0.01 -0.43 0.20 -0.21 0.11 0.56 -0.03 0.00 -0.00 0.00 -0.06 -0.01 -0.04 -0.00 0.06 -0.04 -0.01 0.01 -0.00 0.05 -0.12 0.09 0.15 -0.01 -0.03 -0.00 -0.03 -0.00 -0.11 0.21 0.13 0.15 0.22 -0.07 0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.00 0.10 -0.04 -0.06 0.07 0.10 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 -0.08 0.10 -0.11 0.02 0.13 0.06 -0.01 0.01 0.00 0.04 -0.15 0.06 0.01 0.02 -0.00 0.07 -0.06 -0.11 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.01 0.01 0.03 -0.02 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.04 -0.04 -0.03 0.46 0.09 0.51 -0.00 -0.00 0.00 0.17 0.68 -0.03 0.00 -0.00 -0.00 0.01 0.01 0.01 -0.01 -0.00 -0.00 0.03 -0.02 0.01 0.00 -0.00 0.00 -0.02 0.02 0.00 -0.01 0.00 -0.02 0.00 -0.00 0.00 -0.01 0.00 -0.01 0.00 0.01 -0.00 0.00 -0.00 0.00 -0.04 -0.01 -0.03 -0.01 0.03 -0.03 0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.02 -0.01 0.04 0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.01 0.00 -0.00 0.00 -0.00 0.01 -0.01 0.01 -0.00 -0.02 -0.01 0.00 -0.01 -0.00 -0.02 0.08 -0.03 0.01 0.00 0.01 -0.07 0.02 0.05 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.06 -0.01 -0.05 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.00 -0.00 -0.00 -0.00 0.02 0.00 0.02 -0.01 -0.01 0.00 0.01 0.03 -0.00 -0.00 0.00 0.01 -0.03 -0.03 -0.07 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 -0.00 0.06 -0.08 -0.01 0.05 -0.01 0.09 -0.01 0.03 -0.01 0.28 -0.13 0.14 -0.08 -0.37 0.03 -0.00 0.00 -0.00 0.01 0.00 0.01 -0.00 -0.01 0.01 -0.02 0.01 -0.01 0.11 -0.25 0.19 0.30 -0.02 -0.08 0.00 -0.02 0.00 -0.12 0.17 0.05 0.11 0.16 -0.06 0.00 0.00 0.00 -0.03 -0.00 -0.00 -0.00 -0.02 -0.02 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.04 0.01 -0.22 0.29 -0.31 0.04 0.39 0.17 -0.00 0.00 0.00 0.01 -0.02 0.01 0.00 0.01 -0.00 0.01 -0.01 -0.02 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.05 -0.03 0.05 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 0.00 0.00 -0.06 -0.01 -0.06 -0.00 -0.00 0.00 -0.01 -0.06 0.01 0.00 0.00 -0.00 0.02 0.03 0.04 0.00 0.00 0.00 -0.00 0.00 -0.00 0.02 -0.01 0.01 -0.19 0.24 0.04 -0.17 0.00 -0.25 -0.00 0.00 -0.00 0.04 -0.02 0.01 -0.01 -0.05 -0.00 0.03 -0.02 0.04 -0.46 -0.08 -0.36 -0.01 0.48 -0.34 -0.00 0.00 -0.00 0.02 -0.05 0.04 0.05 -0.00 -0.01 -0.00 -0.01 -0.00 -0.03 0.06 0.03 0.04 0.06 -0.02 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.03 0.01 0.02 -0.02 -0.03 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.02 0.01 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.00 -0.04 0.16 -0.06 0.02 -0.00 0.02 -0.07 0.08 0.13 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.03 -0.05 0.01 -0.00 -0.00 -0.00 0.01 0.00 0.01 -0.03 -0.03 0.00 -0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.02 -0.01 0.01 -0.14 0.17 0.03 -0.13 0.01 -0.19 -0.01 0.01 -0.00 0.12 -0.06 0.07 -0.04 -0.17 0.02 -0.01 0.01 -0.01 0.13 0.02 0.10 0.01 -0.14 0.09 0.01 -0.00 0.00 -0.03 0.06 -0.04 -0.09 0.01 0.03 -0.00 -0.05 -0.00 -0.27 0.43 0.20 0.30 0.43 -0.15 -0.00 -0.00 -0.00 0.01 0.00 0.00 0.00 0.01 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 0.00 0.01 -0.00 -0.01 0.02 -0.01 0.14 -0.19 0.20 -0.02 -0.23 -0.10 -0.00 0.01 0.00 0.02 -0.06 0.02 0.03 0.03 0.02 0.03 -0.03 -0.05 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.02 -0.01 0.02 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.02 0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 -0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.01 0.01 0.02 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.04 0.03 -0.02 0.36 -0.43 -0.08 0.34 -0.01 0.47 -0.00 0.00 -0.00 0.04 -0.02 0.02 -0.01 -0.06 0.01 0.01 -0.01 0.01 -0.21 -0.04 -0.16 -0.03 0.24 -0.14 0.01 -0.01 0.00 -0.05 0.11 -0.09 -0.13 0.01 0.03 -0.00 -0.02 -0.00 -0.11 0.17 0.07 0.11 0.16 -0.06 -0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.02 -0.01 -0.02 0.00 -0.00 0.01 -0.00 0.08 -0.10 0.11 -0.01 -0.13 -0.05 0.00 -0.00 -0.00 -0.01 0.03 -0.01 -0.02 0.00 -0.03 -0.01 0.02 0.03 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.02 0.01 0.02 -0.04 0.00 -0.03 0.00 -0.00 0.00 0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 0.05 -0.01 -0.06 0.05 -0.07 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.05 0.01 0.02 0.00 -0.00 0.00 -0.00 0.00 0.01 -0.02 0.03 0.01 0.03 0.03 0.09 0.32 -0.52 -0.26 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.03 -0.15 0.07 0.05 0.03 0.03 -0.04 -0.01 0.01 0.56 0.13 -0.17 -0.01 -0.04 0.03 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.02 0.02 0.02 -0.00 0.02 0.02 0.07 -0.23 -0.25 -0.03 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.05 -0.08 0.04 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 0.03 0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.02 -0.01 -0.02 0.21 -0.02 0.15 0.01 -0.01 0.01 0.01 0.00 0.00 0.00 0.01 -0.00 -0.01 -0.21 0.05 -0.10 0.08 -0.11 -0.02 0.01 -0.03 -0.00 0.00 0.00 0.04 -0.01 -0.01 -0.01 0.00 -0.01 0.00 -0.00 -0.03 0.02 -0.02 -0.01 -0.00 -0.02 -0.02 -0.22 0.37 0.18 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 -0.01 0.01 0.03 0.13 -0.06 -0.05 -0.03 -0.03 -0.02 -0.00 0.00 0.36 0.09 -0.11 -0.01 -0.03 0.03 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.04 0.03 0.03 -0.00 0.02 0.02 0.10 -0.31 -0.33 -0.04 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.02 0.01 0.23 0.36 -0.19 -0.01 0.00 0.04 -0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.02 0.01 0.02 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.02 0.01 0.02 -0.03 0.00 -0.02 0.00 -0.00 0.01 0.03 0.01 -0.00 -0.00 -0.00 0.00 0.00 0.05 -0.01 -0.08 0.06 -0.09 0.01 -0.00 0.01 0.01 -0.00 -0.01 -0.24 0.03 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 -0.01 -0.03 -0.02 0.04 0.02 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.01 -0.07 0.03 0.00 0.00 -0.00 0.01 0.00 -0.00 -0.11 -0.03 0.03 0.00 0.00 -0.00 0.01 -0.02 -0.00 0.13 0.11 -0.08 -0.21 0.19 0.17 -0.00 0.00 0.00 0.01 -0.03 -0.03 -0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.01 0.01 0.00 -0.00 -0.00 -0.01 -0.04 -0.03 0.22 0.66 0.49 -0.04 0.01 -0.07 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.03 -0.01 -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.01 -0.02 -0.01 -0.02 -0.36 0.03 -0.25 0.01 -0.00 0.01 0.01 0.00 0.00 -0.00 -0.04 0.01 0.03 0.67 -0.17 -0.09 0.07 -0.10 0.07 -0.03 0.08 -0.00 0.00 0.00 0.07 -0.01 -0.03 0.02 -0.00 0.01 -0.01 0.00 0.08 0.01 -0.01 -0.01 0.02 0.00 0.04 -0.13 0.22 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 -0.02 0.00 -0.01 -0.00 -0.01 0.00 0.02 0.11 -0.05 0.01 0.00 0.01 -0.00 -0.00 -0.00 0.01 0.00 -0.00 0.00 -0.01 0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.02 0.02 0.01 -0.00 0.02 0.01 0.07 -0.23 -0.24 -0.03 0.00 0.01 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.06 -0.10 0.05 0.00 -0.00 -0.02 0.00 0.01 0.00 -0.03 -0.08 -0.06 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.11 -0.05 -0.09 -0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.02 -0.00 -0.00 -0.00 -0.01 0.01 -0.02 -0.04 -0.01 -0.00 -0.00 -0.02 0.00 0.01 0.37 -0.09 0.22 -0.16 0.24 0.04 -0.02 0.05 0.00 -0.00 -0.00 -0.05 0.01 0.02 0.00 0.00 -0.00 -0.01 0.00 0.02 0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.03 0.04 0.02 -0.01 0.00 -0.00 -0.01 -0.01 -0.00 0.10 -0.01 0.05 -0.00 -0.00 -0.00 0.00 0.01 -0.00 0.02 0.01 0.01 -0.03 -0.00 0.01 0.41 0.10 -0.12 -0.01 -0.02 0.01 -0.01 0.01 0.01 0.01 0.02 -0.01 0.11 -0.10 -0.08 0.00 -0.02 -0.02 -0.10 0.32 0.34 0.05 -0.00 -0.02 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.02 0.01 0.20 0.31 -0.16 -0.01 0.00 0.03 -0.00 -0.01 -0.01 0.04 0.12 0.09 -0.01 0.00 -0.01 -0.01 0.00 0.01 0.09 -0.03 -0.17 0.07 -0.03 -0.05 -0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.09 0.03 0.10 0.03 -0.00 0.02 -0.00 0.00 -0.00 0.01 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.12 -0.03 0.01 -0.00 0.01 0.02 -0.01 0.03 -0.00 -0.00 -0.01 -0.02 0.00 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.01 -0.01 -0.03 0.00 -0.00 -0.00 0.02 -0.01 0.01 0.04 0.06 0.01 -0.28 0.04 -0.14 0.00 0.00 -0.00 -0.02 -0.08 0.03 0.01 0.01 0.01 -0.00 -0.00 0.00 0.07 0.02 -0.02 -0.00 -0.00 0.00 0.00 -0.01 -0.00 0.08 0.06 -0.05 -0.10 0.08 0.07 0.00 -0.01 -0.01 -0.03 0.11 0.12 0.01 -0.00 -0.01 0.00 0.00 0.00 -0.01 -0.03 -0.00 0.00 0.00 -0.00 -0.01 -0.01 0.00 0.09 0.13 -0.07 -0.00 0.00 0.02 0.00 0.00 0.00 -0.02 -0.06 -0.04 0.00 -0.00 0.01 0.03 -0.01 -0.05 -0.40 0.15 0.75 0.03 -0.01 -0.02 0.00 0.04 -0.06 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.03 0.01 0.03 0.28 -0.02 0.19 0.01 -0.01 0.01 0.02 0.01 0.00 -0.00 -0.02 0.00 0.01 0.33 -0.08 -0.15 0.11 -0.16 0.05 -0.02 0.06 0.01 -0.00 -0.00 -0.11 0.02 0.04 -0.02 0.00 -0.01 -0.01 -0.00 -0.01 -0.00 0.02 0.02 -0.07 -0.03 -0.15 0.13 -0.21 -0.10 0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 0.02 -0.01 -0.06 -0.30 0.13 0.08 0.05 0.04 0.02 0.00 -0.01 -0.36 -0.09 0.11 0.01 0.02 -0.02 0.00 -0.00 -0.00 0.02 0.01 -0.01 -0.04 0.03 0.03 -0.00 0.01 0.00 0.02 -0.08 -0.08 -0.02 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 -0.01 -0.02 0.01 0.23 0.36 -0.19 -0.01 0.00 0.05 0.00 0.01 0.01 -0.05 -0.14 -0.11 0.01 -0.00 0.01 -0.01 0.00 0.01 0.09 -0.03 -0.16 0.03 -0.01 -0.02 -0.00 -0.01 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.10 0.03 0.10 -0.03 0.00 -0.02 -0.01 0.01 -0.02 -0.06 -0.02 -0.00 0.00 0.00 0.00 -0.00 -0.02 0.00 0.24 -0.18 0.27 -0.01 0.00 -0.01 0.02 -0.01 -0.01 -0.33 0.05 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.00 -0.01 -0.01 -0.03 -0.06 0.09 0.05 -0.01 0.00 -0.00 -0.00 0.00 -0.00 0.14 -0.02 0.06 0.00 0.02 -0.01 -0.06 -0.30 0.13 0.02 0.01 0.00 0.01 0.00 -0.00 -0.12 -0.03 0.04 0.00 0.00 -0.00 -0.02 0.02 0.02 -0.05 -0.03 0.03 0.36 -0.32 -0.27 -0.00 0.02 0.02 0.08 -0.26 -0.27 -0.02 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.02 0.01 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.03 0.09 0.06 -0.01 0.01 -0.02 0.01 -0.00 -0.01 -0.09 0.04 0.17 -0.01 0.00 0.01 -0.00 0.01 -0.02 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.10 -0.03 -0.10 0.29 -0.02 0.20 -0.01 0.01 -0.01 -0.04 -0.01 -0.00 -0.00 -0.01 -0.00 0.00 0.16 -0.04 0.17 -0.13 0.19 0.04 -0.01 0.05 -0.02 0.01 0.02 0.39 -0.06 -0.15 -0.02 0.00 -0.01 -0.00 -0.00 -0.02 -0.01 0.01 0.01 -0.02 -0.00 -0.04 0.13 -0.21 -0.10 -0.00 -0.00 -0.00 0.00 0.01 -0.00 0.02 -0.00 0.01 -0.01 -0.03 0.01 0.10 0.45 -0.20 -0.01 -0.02 0.00 0.01 0.00 -0.00 -0.18 -0.04 0.05 0.00 0.01 -0.00 -0.01 0.00 0.01 0.09 0.09 -0.06 0.12 -0.11 -0.09 -0.00 0.01 0.01 0.05 -0.16 -0.17 -0.01 0.00 0.01 0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.01 -0.01 0.06 0.19 0.14 -0.01 -0.00 -0.01 0.00 -0.00 -0.01 -0.06 0.02 0.12 0.06 -0.03 -0.04 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.01 0.03 0.01 0.03 0.56 -0.05 0.38 0.00 -0.00 0.00 0.01 0.00 0.00 -0.00 -0.01 -0.00 0.00 0.23 -0.06 -0.05 0.04 -0.06 0.07 -0.02 0.09 0.01 -0.00 -0.01 -0.17 0.03 0.06 -0.04 0.00 -0.02 -0.00 -0.01 -0.05 0.00 -0.01 -0.02 0.09 0.04 0.20 -0.11 0.17 0.08 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.02 -0.00 0.01 0.00 0.00 -0.00 -0.02 -0.07 0.03 -0.01 -0.00 -0.00 -0.01 -0.00 0.00 0.14 0.03 -0.04 -0.00 -0.01 0.01 0.00 0.00 -0.00 -0.06 -0.05 0.04 -0.01 0.01 0.01 0.00 -0.00 -0.00 -0.02 0.06 0.06 0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 0.00 0.02 0.02 -0.01 -0.24 -0.38 0.20 0.01 0.00 -0.03 0.00 0.00 0.00 -0.01 -0.04 -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.13 -0.06 -0.10 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 -0.01 0.02 -0.00 0.01 -0.02 0.02 -0.02 -0.04 -0.01 -0.01 -0.00 0.00 -0.00 -0.00 -0.05 0.01 0.34 -0.25 0.37 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.03 0.01 0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.02 -0.01 -0.04 -0.03 0.06 0.03 0.02 -0.00 0.01 0.02 0.01 0.01 -0.36 0.05 -0.17 0.00 0.01 -0.00 -0.03 -0.14 0.07 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.03 -0.00 0.28 0.23 -0.18 -0.26 0.22 0.20 -0.00 0.01 0.01 0.04 -0.13 -0.14 -0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.04 -0.07 0.04 0.00 -0.00 -0.01 0.00 0.01 0.01 -0.05 -0.14 -0.11 0.01 -0.00 0.02 -0.01 0.00 0.01 0.11 -0.04 -0.21 0.09 -0.04 -0.07 -0.00 -0.02 0.02 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.01 -0.01 -0.00 -0.01 -0.03 0.00 -0.02 0.01 -0.01 0.01 0.00 -0.00 0.01 -0.00 0.01 -0.01 -0.01 -0.12 0.03 -0.22 0.16 -0.24 0.04 -0.01 0.05 0.01 -0.00 -0.00 -0.09 0.01 0.03 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.04 -0.02 -0.08 0.00 0.00 0.00 0.01 -0.00 0.01 0.01 0.01 0.00 -0.20 0.03 -0.09 0.00 -0.00 0.00 0.01 0.05 -0.02 -0.04 -0.02 -0.03 -0.00 -0.00 0.00 0.06 0.01 -0.02 -0.00 -0.00 0.00 -0.05 -0.01 0.03 0.43 0.39 -0.28 0.30 -0.30 -0.24 0.00 -0.00 -0.01 -0.02 0.07 0.08 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.02 -0.04 0.02 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.01 -0.03 -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 0.04 -0.01 -0.07 0.22 -0.09 -0.17 0.00 -0.02 0.02 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.02 0.00 -0.00 0.01 -0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.01 -0.03 0.02 -0.03 0.01 -0.00 0.02 -0.04 0.01 0.02 0.67 -0.10 -0.26 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.08 0.13 0.06 -0.01 0.00 -0.00 -0.01 -0.01 -0.00 0.09 -0.01 0.04 0.00 0.03 -0.02 -0.12 -0.55 0.25 0.07 0.05 0.03 -0.00 -0.00 0.00 0.05 0.01 -0.02 -0.00 -0.01 0.01 -0.01 -0.00 0.00 0.05 0.05 -0.04 0.04 -0.04 -0.03 0.00 -0.00 -0.00 -0.01 0.02 0.02 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.03 -0.05 0.03 0.00 -0.00 -0.01 -0.00 -0.01 -0.01 0.04 0.12 0.09 0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.01 0.03 -0.01 -0.03 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.03 0.01 0.03 0.01 0.00 0.01 -0.10 0.01 -0.07 -0.00 0.00 -0.00 0.01 0.00 -0.00 -0.01 0.02 -0.02 -0.02 -0.23 0.06 0.03 -0.02 0.04 0.21 -0.05 0.25 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 -0.01 -0.00 -0.02 0.14 0.07 0.34 0.03 -0.06 -0.04 -0.01 0.00 -0.01 -0.01 -0.01 -0.00 0.24 -0.03 0.11 0.00 0.00 0.00 0.00 -0.00 0.00 -0.08 -0.04 -0.05 0.01 0.00 -0.00 -0.11 -0.03 0.03 0.00 0.01 -0.01 0.01 -0.00 -0.01 -0.07 -0.06 0.04 -0.09 0.09 0.07 -0.00 0.00 0.00 0.01 -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 -0.03 -0.01 -0.02 0.02 0.02 -0.01 -0.01 0.00 0.08 0.13 -0.07 -0.01 0.00 0.02 0.00 0.00 0.00 -0.01 -0.04 -0.03 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.03 0.01 0.06 0.53 -0.24 -0.41 0.00 -0.02 0.02 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.06 0.02 0.07 0.02 -0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.02 -0.00 0.02 -0.02 0.03 -0.02 0.00 -0.03 -0.00 -0.00 -0.01 -0.05 0.01 0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 0.02 -0.14 -0.07 -0.32 -0.00 0.02 0.02 -0.04 0.01 -0.02 -0.05 -0.06 -0.01 0.66 -0.09 0.31 -0.00 -0.00 0.00 0.01 0.04 -0.02 -0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.07 0.02 -0.02 -0.00 -0.01 0.01 -0.01 -0.02 0.00 0.28 0.24 -0.19 -0.16 0.13 0.12 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.05 -0.08 0.04 0.00 -0.00 -0.01 0.00 0.01 0.01 -0.05 -0.15 -0.12 0.01 -0.00 0.02 0.00 -0.00 -0.01 -0.07 0.03 0.13 -0.03 0.01 0.03 -0.00 0.02 -0.02 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.01 -0.06 -0.02 -0.07 -0.03 0.00 -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.03 0.02 -0.04 -0.01 -0.11 0.02 -0.00 0.00 -0.00 0.54 -0.13 0.63 0.01 0.00 0.00 -0.03 0.01 0.01 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.01 0.00 0.02 -0.13 -0.06 -0.29 -0.02 0.04 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 -0.06 0.01 -0.03 -0.01 -0.01 -0.01 0.00 0.02 -0.01 0.21 0.10 0.13 -0.00 -0.00 0.00 0.06 0.01 -0.02 -0.00 -0.01 0.00 0.00 0.00 -0.00 -0.06 -0.06 0.04 0.01 -0.01 -0.01 0.00 -0.00 -0.00 -0.00 0.01 0.01 0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.04 -0.09 -0.01 -0.06 0.05 0.04 0.00 0.00 -0.00 -0.04 -0.06 0.03 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.15 0.06 0.11 -0.00 0.01 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 0.01 0.53 0.18 0.61 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.00 0.00 -0.00 0.00 0.01 -0.01 0.02 -0.04 -0.01 -0.03 0.11 -0.02 -0.06 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.01 0.01 0.02 -0.14 -0.06 -0.31 0.02 -0.02 -0.00 0.01 -0.00 0.00 0.01 0.01 0.00 -0.10 0.02 -0.05 0.01 -0.00 0.01 0.02 0.10 -0.05 -0.14 -0.07 -0.08 -0.00 -0.00 0.00 0.04 0.01 -0.01 -0.00 -0.00 0.00 0.01 0.01 -0.00 -0.13 -0.12 0.09 0.01 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.02 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.03 -0.04 0.02 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.02 0.05 0.04 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.06 -0.02 -0.12 0.14 -0.06 -0.11 -0.01 0.01 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.02 -0.01 -0.01 0.30 0.10 0.34 -0.01 0.00 -0.01 0.00 0.00 0.00 -0.01 -0.01 0.00 -0.01 0.00 -0.01 0.00 0.01 -0.01 -0.00 0.00 -0.00 0.13 -0.03 0.15 -0.02 -0.01 -0.02 0.04 -0.01 -0.03 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.02 -0.01 -0.03 0.25 0.12 0.56 -0.01 0.00 -0.01 -0.00 0.00 -0.00 -0.02 -0.03 -0.00 0.08 -0.01 0.04 -0.01 -0.01 -0.00 0.01 0.08 -0.04 0.14 0.06 0.09 0.00 0.00 -0.00 -0.08 -0.02 0.02 0.00 0.01 -0.01 -0.01 -0.01 0.01 0.21 0.19 -0.14 0.00 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 0.05 0.08 -0.05 -0.00 0.00 0.01 0.00 0.00 0.00 -0.01 -0.02 -0.02 0.00 -0.00 0.01 -0.00 -0.00 0.00 0.03 -0.01 -0.05 -0.31 0.14 0.24 -0.01 0.03 -0.02 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.01 0.01 0.06 0.02 0.07 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.01 0.00 -0.07 0.03 0.00 -0.00 0.00 -0.16 0.05 -0.19 -0.00 -0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 0.00 -0.00 0.00 -0.02 -0.01 -0.05 -0.03 0.05 0.02 0.00 -0.00 0.00 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.05 -0.03 -0.02 0.01 0.10 -0.06 0.71 0.35 0.44 -0.00 -0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.03 -0.03 0.02 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.02 0.04 0.00 0.02 -0.02 -0.01 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.19 -0.08 -0.15 0.01 -0.05 0.04 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.03 -0.01 -0.03 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.01 -0.00 -0.01 0.00 -0.01 -0.00 -0.01 0.00 0.00 -0.00 0.00 0.09 -0.02 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.04 0.09 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.04 -0.02 0.02 0.28 0.72 0.05 0.38 -0.36 -0.32 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.02 0.00 0.02 -0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.07 -0.01 0.02 0.01 0.00 0.00 -0.09 -0.05 0.00 -0.00 0.00 -0.00 0.00 -0.05 0.01 -0.00 0.00 -0.01 0.01 -0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.06 -0.27 0.13 0.94 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 -0.03 -0.06 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 0.01 -0.01 -0.01 0.00 0.00 -0.00 -0.01 -0.01 0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.01 0.01 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 -0.00 0.03 0.02 0.00 -0.50 -0.28 0.01 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.03 -0.03 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.02 -0.04 -0.00 0.33 0.69 0.04 0.05 -0.03 0.03 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.02 0.02 0.02 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.02 0.01 -0.08 -0.19 -0.01 0.10 -0.08 -0.08 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.02 -0.01 -0.04 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 0.01 0.01 -0.00 0.00 -0.05 -0.02 -0.00 0.70 0.40 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.02 -0.04 0.04 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.03 0.01 0.11 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 0.00 -0.00 -0.02 -0.03 -0.00 0.22 0.45 0.03 0.03 -0.02 0.02 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.01 -0.01 0.02 -0.02 -0.02 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.01 0.00 -0.00 -0.00 0.02 0.01 -0.08 -0.19 -0.01 0.11 -0.09 -0.09 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.02 -0.01 -0.03 -0.01 0.00 0.01 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.02 0.01 0.02 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.06 -0.04 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.04 0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.01 0.02 0.00 -0.15 -0.32 -0.02 -0.02 0.01 -0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.01 0.01 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.02 0.06 0.03 -0.22 -0.49 -0.02 0.50 -0.41 -0.39 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.01 0.01 -0.01 -0.01 0.00 0.02 -0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.02 0.01 -0.00 0.00 -0.00 -0.02 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 0.01 0.00 -0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.00 0.04 0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.01 0.02 0.00 -0.01 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.01 -0.02 0.01 -0.05 0.04 0.03 -0.03 -0.04 0.04 -0.03 -0.03 -0.12 0.80 -0.57 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.00 0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.04 0.04 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.04 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.03 0.02 -0.05 0.01 0.07 0.02 0.48 -0.36 0.79 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.02 -0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.01 0.01 -0.02 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.01 -0.00 0.00 0.01 -0.10 0.08 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.06 -0.00 0.02 -0.01 -0.05 -0.04 0.96 0.07 -0.21 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.05 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.02 0.02 -0.04 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.02 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.02 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.06 -0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.06 -0.03 -0.07 0.01 -0.20 0.24 0.94 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.05 0.04 0.06 -0.01 -0.00 -0.06 0.77 -0.61 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.02 -0.02 0.13 0.01 -0.03 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 -0.01 0.01 0.03 -0.00 0.00 -0.00 0.01 0.00 0.01 0.03 -0.03 0.04 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 5 9 9 9 8 1 1 8 1 8 1 1 1 8 1 8 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 1 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 5 9 9 9 8 1 1 8 1 8 1 1 1 8 1 8 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 8 1 1 1 11.00931 18.99840 18.99840 18.99840 15.99491 1.00783 1.00783 15.99491 1.00783 15.99491 1.00783 1.00783 1.00783 15.99491 1.00783 15.99491 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 15.99491 1.00783 1.00783 1.00783 337.15516 0.99857 -0.04853 -0.02223 0.04576 0.99271 -0.11153 0.02748 0.11036 0.99351 asymmetric 1 0.01020 0.00899 0.00832 0.21251 0.18742 0.17344 986570.9 32.52 39.73 49.51 55.41 59.59 63.39 67.25 84.11 89.35 90.68 94.72 95.99 110.93 117.26 126.61 136.62 140.31 149.63 162.38 177.80 184.90 193.32 195.05 210.90 220.54 222.51 235.83 244.56 247.23 277.06 291.61 294.12 301.04 313.45 322.40 325.13 326.62 332.20 346.30 357.11 366.55 371.17 399.16 401.80 419.90 475.05 491.83 511.14 521.59 554.70 581.68 599.54 622.21 642.87 678.51 685.86 702.26 709.52 724.79 733.05 734.91 747.35 754.91 761.30 788.42 802.20 805.11 844.61 871.41 897.95 904.97 924.58 951.74 970.92 977.29 983.93 1013.02 1037.39 1065.01 1074.18 1091.29 1102.60 1118.39 1151.07 1180.66 1187.34 1199.53 1218.89 1241.85 1257.80 1270.00 1300.73 1346.47 1531.54 1809.15 2322.14 2332.73 2336.24 2346.39 2347.77 2348.68 2364.93 2370.79 2374.23 2381.44 2383.02 2396.64 2415.34 2424.17 4779.36 4818.68 4832.23 4851.30 4876.33 4886.15 4918.32 4924.26 4944.88 4965.62 4975.23 5003.43 5010.47 5046.84 5067.80 5087.29 5122.71 5123.75 5177.79 5295.39 5335.14 5350.86 5353.01 5377.50 5504.59 5506.36 5508.94 5509.47 5518.80 0.375765 0.416836 0.417780 0.301392 -1471.117873 -1471.076802 -1471.075858 -1471.192246 261.569 140.672 244.960 0.000 0.000 0.000 0.889 2.981 43.341 0.889 2.981 35.097 259.791 134.710 166.523 1 0.593 1.985 6.391 2 0.593 1.984 5.994 3 0.594 1.983 5.557 4 0.594 1.981 5.334 5 0.594 1.981 5.190 6 0.595 1.980 5.068 7 0.595 1.979 4.951 8 0.596 1.974 4.509 9 0.597 1.972 4.389 10 0.597 1.972 4.360 11 0.597 1.971 4.274 12 0.598 1.970 4.248 13 0.599 1.964 3.963 14 0.600 1.962 3.854 15 0.601 1.958 3.704 16 0.603 1.953 3.555 17 0.603 1.951 3.503 18 0.605 1.946 3.378 19 0.607 1.939 3.219 20 0.610 1.929 3.044 21 0.611 1.925 2.968 22 0.613 1.919 2.883 23 0.613 1.918 2.866 24 0.617 1.906 2.716 25 0.619 1.899 2.631 26 0.620 1.897 2.614 27 0.623 1.887 2.504 28 0.625 1.879 2.436 29 0.626 1.877 2.415 30 0.635 1.850 2.203 31 0.639 1.836 2.109 32 0.640 1.834 2.093 33 0.642 1.827 2.050 34 0.646 1.814 1.977 35 0.649 1.804 1.926 36 0.650 1.801 1.911 37 0.651 1.800 1.902 38 0.653 1.794 1.872 39 0.658 1.778 1.798 40 0.662 1.766 1.743 41 0.665 1.755 1.697 42 0.667 1.749 1.675 43 0.678 1.715 1.549 44 0.680 1.712 1.538 45 0.687 1.689 1.463 46 0.713 1.615 1.259 47 0.721 1.592 1.204 48 0.731 1.564 1.143 49 0.736 1.549 1.111 50 0.754 1.501 1.017 51 0.769 1.461 0.947 52 0.780 1.434 0.903 53 0.793 1.400 0.851 54 0.806 1.368 0.805 55 0.829 1.313 0.733 56 0.833 1.302 0.719 57 0.844 1.276 0.689 58 0.849 1.265 0.675 59 0.859 1.242 0.649 60 0.865 1.229 0.635 61 0.866 1.226 0.632 62 0.874 1.207 0.611 63 0.880 1.195 0.599 64 0.884 1.186 0.589 65 0.903 1.144 0.548 66 0.913 1.123 0.529 67 0.915 1.119 0.525 68 0.944 1.059 0.472 69 0.964 1.020 0.440 0.161905e+35 34.209259 78.769730 0.637195e+19 18.804272 43.298437 0.100000e+01 0.000000 0.000000 0.243332e+09 8.386199 19.309936 0.104421e+08 7.018788 16.161357 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 5.3053 0.3176 2.6528 5.9401 -156.8445 -194.6569 -164.2704 -0.2669 1.8025 -4.7386 15.0794 -22.7330 7.6535 -0.2669 1.8025 -4.7386 177.2296 -83.2513 65.4616 17.4629 13.5521 -10.6152 -6.1919 -35.8135 -36.9437 6.8682 -3884.8310 -4067.7202 -2675.3134 -102.5290 -145.2055 -55.4038 -19.9558 74.6271 -117.2806 -1360.2344 -1283.3050 -1159.4114 106.4412 54.3290 56.8272 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) 0 1-A -1471.4936382 7.616E-10 1.679E-5 0.375765 0.4168361 -1471.0768021 -1471.0758579 -1471.1922463 -2.7046126,10.6089377,-7.9043251,-2.6369111,10.9404344,4.2770082 C01 [X(B1F3H29O15)] 0.6051534 -2.2232798 -0.3904495 2.4595187 -0.0803288 -0.0408536 -0.0281129 2.323937 0.0018676 -0.0641925 0.004252 2.3396263 -0.7410162 0.0180316 -0.0326031 0.0338032 -0.6392543 -0.1674279 -0.0219095 -0.1688986 -1.4236281 -1.0403357 -0.3859621 -0.138681 -0.3876025 -1.0005191 -0.1898669 -0.130193 -0.1782683 -0.6936267 -0.7397202 0.0899309 -0.0473745 0.0934417 -1.26735 0.3179223 -0.0423594 0.3014568 -0.9078148 -1.6517424 0.2037524 0.072945 0.2356114 -1.178014 -0.1500079 0.0776513 -0.1402278 -1.1459557 0.5260411 -0.1985532 -0.112928 -0.242623 0.6453999 0.0891489 -0.125954 0.0907019 0.4680867 0.4631204 -0.2712186 -0.0283395 -0.2189825 0.9051049 -0.0046965 -0.0179035 -0.0069645 0.4118887 -1.1262661 -0.0692101 0.0442809 -0.0500903 -1.1956583 0.0710092 0.0641482 0.1102615 -0.7695031 0.4473938 0.0273049 0.0005249 0.0564467 0.5647369 0.1644919 0.0256289 0.12399 0.4241151 -1.1137491 -0.0552302 -0.0617551 -0.0418984 -1.173605 0.1194546 -0.0449627 0.1086028 -1.2089672 0.454473 0.1276105 -0.1552105 0.136733 0.4572457 -0.2554949 -0.156288 -0.2227392 0.8955919 0.4750811 -0.1577794 0.0667932 -0.1586026 0.8929633 -0.2245004 0.0514558 -0.1873693 0.416789 0.5326727 -0.1426674 0.153914 -0.159481 0.6681621 -0.1553896 0.1771805 -0.1909661 0.4401433 -0.8713556 -0.0231747 0.0436117 -0.0179675 -1.1882321 -0.0501878 0.042265 -0.0412881 -1.2094746 0.4959634 0.2365906 0.0611674 0.2877874 0.8052002 0.1318949 0.0639475 0.1159704 0.4581492 -0.9233021 0.1331934 0.1161212 0.1450026 -1.0515601 0.1627205 0.0937474 0.1307193 -1.1171484 0.5534559 -0.0196662 0.1270779 -0.0754901 0.3477842 -0.049976 0.0825631 -0.0147521 0.5288422 -1.1238503 -0.095333 -0.039905 -0.1105279 -1.0975355 -0.1277309 -0.027914 -0.1339998 -1.2481187 0.6200947 -0.2889167 0.0530608 -0.2430522 0.6369729 -0.0238958 0.0355829 -0.013136 0.4029263 0.7493409 0.3367305 -0.1639908 0.2862717 0.6070693 -0.1140345 -0.1517457 -0.1275352 0.4462338 -1.1351436 -0.0008931 -0.1246702 0.0198862 -1.0519332 -0.0583055 -0.107259 -0.062734 -0.816778 0.4289349 0.0007582 -0.0300957 -0.0257195 0.3733367 0.0743545 -0.0075917 -0.0008279 0.573804 0.4320939 -0.1319771 0.0564497 -0.1154231 0.8973424 -0.0685896 0.0438176 -0.0239228 0.375481 -1.0538275 -0.1173457 0.144265 -0.1311135 -0.9761432 -0.0222475 0.1335831 -0.0124861 -1.1691388 0.4044035 0.0260318 -0.0267856 0.0153181 0.3627473 -0.0496349 -0.0123385 -0.0971706 0.9853219 0.5407571 -0.1354651 -0.105629 -0.1352506 0.5660556 0.1709223 -0.1317685 0.2109661 0.4615399 -1.156482 -0.1252668 0.0129917 -0.1394376 -0.8904935 -0.2428756 0.0308579 -0.2114774 -0.9213515 0.4638791 0.1334663 0.1265497 0.1301668 0.7224139 0.345937 0.1422366 0.3717544 0.6679157 0.4288174 -0.0097696 -0.0204295 -0.0061178 0.3456993 0.0659878 -0.0313053 0.0124283 0.3652588 -1.1948401 0.0253666 0.0741517 0.0230083 -1.2360086 -0.0782162 0.0641871 -0.0762073 -1.0224898 0.3543188 0.0024915 0.0864519 -0.0145362 0.5201237 0.2502382 0.0446127 0.2196702 0.8279402 0.8217364 0.2587866 -0.1084185 0.2708284 0.5467425 -0.094425 -0.0619569 -0.0562441 0.3850749 -1.1280254 -0.0537658 -0.021373 -0.027099 -0.9474701 0.2404415 -0.0016372 0.2427118 -0.8379098 0.995291 0.1728624 -0.1136121 0.1984037 0.4063167 -0.084292 -0.1105238 -0.0807266 0.4230694 0.3803799 0.0424703 0.0329618 -0.0087141 0.3279198 -0.0684555 0.0020902 -0.0787098 0.376379 -0.9462983 0.1674602 0.0107594 0.1299427 -0.9889622 0.1241132 0.0078279 0.1168151 -0.8388458 0.4552718 -0.1080238 -0.1087973 -0.0724904 0.4895252 0.0384453 -0.0726392 0.0698037 0.4813671 0.5087278 0.113237 -0.0097863 0.064191 0.5360488 -0.0355523 -0.0349348 -0.0533561 0.369292 -0.6694338 0.0598595 -0.0935358 0.04696 -1.108388 -0.0140255 -0.1271061 -0.0111878 -1.114268 0.3521295 0.0331889 0.1401335 0.019307 0.4127932 0.0370983 0.1111718 0.0452737 1.0389981 0.2794615 0.0176047 0.0006459 0.028295 0.4224803 -0.0170527 0.0600288 -0.0273926 0.3807146 -1.1371545 -0.0351237 0.0604781 -0.0663045 -0.9819323 -0.2193987 0.0896177 -0.2346255 -0.8083476 0.8664486 -0.1870929 -0.2523887 -0.2062017 0.4545428 0.152299 -0.2402549 0.1502566 0.5093894 0.3980723 -0.0033269 0.0130421 0.0324367 0.3529976 0.0586506 -0.0100576 0.0921191 0.3475832 -1.1763395 0.1559352 -0.0468476 0.1580402 -0.9715569 -0.2230095 -0.046917 -0.2184504 -0.8968289 0.9401867 0.1137818 0.1731752 0.086732 0.4178187 0.062978 0.2060957 0.0688571 0.4451659 0.7247559 0.2655661 0.1595328 0.2241174 0.5398515 0.0589727 0.1266347 0.0457538 0.4448488 0.3760605 -0.065921 0.0529255 -0.0398921 0.3952839 0.0503413 0.0027805 0.0392992 0.4586588 187.9945964|0.7239654|192.0489367|-0.6768506|1.3556828|186.7410834 0.000050482 0.000034790 0.000009916 -0.000004698 -0.000002999 -0.000017685 -0.000033323 -0.000028352 -0.000010673 -0.000010861 -0.000000937 -0.000000077 0.000008600 0.000011474 0.000026830 -0.000001269 0.000000823 -0.000000176 0.000006233 0.000006136 -0.000017482 -0.000002166 -0.000009836 -0.000017686 0.000003062 0.000003197 0.000007409 -0.000021870 0.000025828 0.000015411 -0.000004828 -0.000031301 0.000022962 0.000003088 0.000009333 0.000001379 0.000005383 -0.000003388 -0.000021781 0.000003223 0.000002999 -0.000001349 -0.000009884 -0.000006215 -0.000008852 -0.000005194 0.000004445 0.000018173 -0.000002480 0.000006660 -0.000013825 0.000022275 0.000009955 -0.000036791 -0.000009626 0.000012965 0.000026534 -0.000011345 -0.000010593 0.000029412 -0.000011554 0.000011244 -0.000004619 0.000003204 -0.000001756 0.000000558 0.000010772 -0.000031260 0.000008104 -0.000008489 0.000004217 -0.000025153 0.000015955 0.000006721 0.000033531 0.000005423 -0.000003101 -0.000008519 -0.000021212 -0.000006822 -0.000001531 -0.000003828 -0.000004168 0.000013526 0.000012856 0.000002960 -0.000002156 0.000007757 0.000088512 -0.000025725 -0.000036715 -0.000071538 -0.000003791 -0.000004515 -0.000013748 0.000011762 -0.000006319 -0.000010814 -0.000005705 0.000025805 0.000004706 0.000000274 0.000001016 -0.000004529 0.000006951 0.000005466 -0.000001255 0.000005761 -0.000011815 -0.000000648 -0.000007350 -0.000000358 -0.000003328 -0.000000462 0.000002978 -0.000010606 0.000018566 -0.000009086 0.000001032 -0.000024501 -0.000000468 0.000002379 0.000000579 -0.000001935 -0.000000104 -0.000000264 0.000025799 -0.000004497 -0.000003828 0.000002939 0.000000881 0.000003472 0.000020408 -0.000005056 -0.000014145 -0.000004866 0.000003944 0.000004400 0.000004986 0.000004167 0.000000269 -0.000009008 0.000007483 0.000008347 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; Gaussian 16 6-Nov-2024 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 138 C1[X(BF3H29O15)] RB3LYP 6-311+G(d,p) SP #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read output=wfx 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; oldchk=/home/lamsabhi/diver/BF3-H2O/14H2OBF3OH/water/CONF223/opt-b3lyp.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Wate 1/29=2,38=1,172=1/1 2/12=2,40=1/2 3/5=4,6=6,7=111,11=2,14=-4,25=1,30=1,70=32201,72=1,74=-5,116=-2,124=41/1,2,3 4/5=1/1 5/5=2,38=6,53=1/2 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,6=200,9=1/99 Wavefunction 14H2OBF3OH CONF223 water Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 11 19 19 19 16 1 1 16 1 16 1 1 1 16 1 16 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 1 11.0093053 18.9984033 18.9984033 18.9984033 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 3 1 1 1 0 1 1 0 1 0 1 1 1 0 1 0 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 1 2.7500000 6.7500000 6.7500000 6.7500000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) 6-311+G(d,p) (5D, 7F) 0.10000e-02 0.10000e-05 F 611 A 592 A 592 916 611 91 91 2087.3848596532 48 48 48 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=141 Grimme-D3(BJ) -0.0589086310 PCM SMD-Coulomb. Total charges None On-the-fly selection Water 78.355300 1.777849 0.000000 1.429564 0.000000 1.418481 2.306729 0.000000 1.448307 2.301244 2.312318 0.000000 1.429197 2.383341 2.331118 2.383573 0.000000 5.520793 6.501634 6.342232 5.424535 4.397805 0.000000 3.984773 3.260297 4.882564 5.030790 3.569580 6.589872 0.000000 3.906074 5.033336 2.844212 4.558264 3.895258 6.529155 6.802997 0.000000 3.042621 4.116965 1.886320 3.753130 3.264165 6.448481 6.128335 0.970396 0.000000 3.603448 3.661322 4.939846 3.868640 2.847990 4.054987 3.109571 6.703725 6.107579 0.000000 3.521692 3.224324 4.830470 4.012968 2.945565 4.963776 2.223884 6.813198 6.146305 0.984428 0.000000 4.294644 5.270630 3.248670 5.177473 4.144068 6.883449 6.655398 0.982740 1.548031 6.916301 6.943130 0.000000 3.518521 3.581841 4.919305 3.426485 3.072751 4.226956 3.740103 6.866508 6.216419 0.978002 1.568511 7.201164 0.000000 6.086233 7.044453 6.834907 6.167957 4.839005 0.977250 6.789814 6.775998 6.787469 4.518637 5.364434 7.014959 4.860422 0.000000 5.958204 7.028103 6.517880 6.131965 4.703822 1.552387 6.943121 6.097338 6.221896 4.950382 5.726560 6.307620 5.321612 0.981655 0.000000 3.736774 2.845655 4.799072 4.572482 3.549735 6.584262 0.983250 7.016263 6.262173 2.764243 1.792562 6.996276 3.182373 6.912385 7.140948 0.000000 2.909438 1.891518 3.925950 3.794167 3.003123 6.556440 1.548281 6.308081 5.496281 2.931950 2.090192 6.347087 3.178721 6.960801 7.101694 0.970888 0.000000 4.020778 4.486114 4.415534 5.167685 2.785432 4.799240 3.486949 4.759003 4.540936 3.859965 3.818538 4.451971 4.647614 4.673201 4.408804 4.129163 4.099043 0.000000 3.048222 3.610573 3.478644 4.213329 1.843102 4.655423 3.272686 4.146531 3.790609 3.449443 3.409571 3.980874 4.102320 4.725301 4.469842 3.742963 3.515637 0.979189 0.000000 4.326590 4.832780 4.941894 5.282148 2.956943 4.045859 3.655834 5.352984 5.147082 3.380116 3.520509 5.162172 4.219558 3.865764 3.735570 4.205370 4.307095 0.987092 1.536966 0.000000 3.651707 4.951712 4.023279 2.900605 3.525636 3.873940 6.923982 4.454615 4.184290 4.891821 5.519259 5.255952 4.547019 4.661351 4.469533 6.668341 6.102938 5.661037 4.909898 5.517914 0.000000 2.865144 4.101116 3.327457 1.953954 3.032213 4.368728 6.340294 4.335936 3.865491 4.503033 5.009757 5.127128 4.088325 5.171475 5.040288 6.012325 5.374794 5.497237 4.648440 5.440573 0.970584 0.000000 3.518616 4.911601 3.712944 3.157083 3.169260 3.690141 6.685493 3.689708 3.543361 4.909473 5.496029 4.437434 4.754500 4.327320 3.960229 6.567178 6.012995 4.997308 4.295229 4.920048 0.980650 1.529774 0.000000 5.080115 5.572997 6.001276 5.658468 3.718248 3.016868 4.287241 6.620126 6.390300 2.832922 3.327517 6.608782 3.647417 2.807280 3.123441 4.591812 4.877976 2.754506 3.034707 1.779296 5.546358 5.584911 5.154935 0.000000 5.325888 6.017983 6.197084 5.730823 3.959787 2.134599 5.147502 6.562782 6.421231 3.288477 3.966482 6.637877 3.930567 1.826911 2.210004 5.377752 5.565701 3.289757 3.484162 2.347462 5.120538 5.319905 4.730457 0.982118 0.000000 4.483705 4.879238 5.562623 4.964272 3.233858 3.069092 3.768168 6.573985 6.214550 1.865377 2.444657 6.652244 2.680638 3.163275 3.574144 3.895800 4.164874 2.975061 2.978940 2.134836 5.152174 5.067900 4.896685 0.976206 1.553007 0.000000 5.531780 6.363573 5.271189 6.588906 4.502157 5.766195 6.089308 3.960713 4.320720 6.330993 6.442081 3.371561 6.986348 5.439018 4.718360 6.739509 6.526488 2.744912 3.108936 3.256944 6.276581 6.381752 5.350682 4.730252 4.801700 5.233883 0.000000 4.883056 5.626777 4.826921 5.984956 3.757065 5.253880 5.148576 4.078006 4.223447 5.409262 5.487228 3.585536 6.105169 4.978849 4.389073 5.798200 5.635629 1.759994 2.201260 2.313378 5.916887 5.938218 5.056738 3.894086 4.089108 4.343930 0.985997 0.000000 5.456542 6.464332 5.188873 6.345849 4.424818 5.243930 6.522784 3.618972 4.088196 6.331910 6.573140 3.214768 6.901146 4.946447 4.131727 7.072544 6.804304 3.141248 3.334199 3.483205 5.649056 5.870718 4.694195 4.737318 4.619282 5.225504 0.965579 1.542556 0.000000 3.594745 4.937364 3.555033 3.959879 2.790774 3.772414 6.095579 2.774756 2.872558 4.935099 5.386419 3.200945 5.135014 4.034642 3.402183 6.250168 5.775721 3.637212 3.108255 3.717258 2.790551 3.055570 1.837451 4.419045 4.099414 4.435403 3.520351 3.309081 2.866735 0.000000 2.780637 4.058310 2.991360 3.310825 1.823319 3.685293 5.144233 3.011722 2.811082 4.059320 4.443951 3.361831 4.293082 4.015924 3.565390 5.271657 4.802242 2.997914 2.319123 3.091640 2.828806 2.825111 2.049002 3.850092 3.703006 3.729217 3.589386 3.124501 3.162585 0.981391 0.000000 3.631479 4.959244 3.205130 4.122997 3.089616 4.755069 6.347373 1.814295 2.075331 5.587012 5.912842 2.285111 5.782217 4.988447 4.307013 6.539887 5.974438 3.910055 3.346302 4.214884 3.275022 3.413356 2.339891 5.184019 4.961641 5.199295 3.385947 3.339835 2.777123 0.983028 1.541663 0.000000 5.360303 6.063823 4.461001 6.498920 4.994703 7.683795 6.673198 2.773866 3.164994 7.516781 7.415938 1.793574 7.993480 7.620720 6.899758 7.232556 6.731395 4.296415 4.167078 5.147794 6.775491 6.646523 5.907444 6.814158 6.987838 7.019102 2.752814 3.153798 3.058951 4.360437 4.411259 3.627099 0.000000 5.322842 6.083305 4.645182 6.465939 4.701486 6.987187 6.360249 3.038639 3.442407 7.040572 7.002719 2.159423 7.588442 6.838763 6.112021 6.969510 6.566420 3.605224 3.629624 4.396252 6.543063 6.493888 5.634504 6.040856 6.192504 6.341426 1.772212 2.252193 2.173800 3.931444 3.989410 3.362668 0.985249 0.000000 6.256352 6.997234 5.292314 7.333990 5.897760 8.317394 7.615029 3.257973 3.823408 8.425127 8.354817 2.321302 8.901436 8.203695 7.418226 8.191615 7.695963 5.121831 5.060905 5.935535 7.408141 7.351446 6.513882 7.573683 7.689579 7.842773 3.180924 3.791189 3.416614 4.961989 5.154745 4.188644 0.965080 1.549492 0.000000 3.739926 3.979402 5.031966 2.891397 3.824700 4.752648 5.308966 7.065389 6.381187 2.846672 3.337031 7.621881 1.897654 5.612961 6.033145 4.610766 4.317423 6.073110 5.355968 5.731199 3.884647 3.348166 4.458581 5.208729 5.229477 4.309647 8.062126 7.291232 7.809790 5.476497 4.794118 6.071065 8.755042 8.475308 9.624641 0.000000 4.021697 4.536843 5.245714 3.170518 3.858472 3.937268 5.732565 6.931718 6.353954 2.954706 3.669573 7.516061 2.136374 4.843075 5.286429 5.151128 4.897367 5.970721 5.306204 5.533915 3.355401 3.043658 3.948762 4.860185 4.711738 4.046345 7.785929 7.060976 7.444161 5.048717 4.476498 5.743943 8.682908 8.334316 9.512364 0.971425 0.000000 2.904960 3.245778 4.134367 1.936712 3.231726 4.932921 5.100433 6.261388 5.534298 3.028719 3.389192 6.843586 2.204798 5.781619 6.051737 4.436970 3.955024 5.744706 4.929156 5.547398 3.390914 2.681072 3.928001 5.324811 5.370098 4.462371 7.599822 6.868996 7.349038 4.946434 4.253861 5.425397 8.042655 7.842453 8.907461 0.970973 1.526668 0.000000 4.889465 4.478958 5.464442 6.142117 4.171307 6.868972 1.796069 6.715280 6.233445 4.219631 3.569807 6.331658 5.043208 6.827924 6.832473 2.778250 3.163556 2.769772 3.022845 3.131236 7.620550 7.181488 7.166741 4.194547 5.101301 4.079946 5.101686 4.217961 5.736159 6.130517 5.302618 6.304358 5.897940 5.476015 6.763076 6.714921 6.963207 6.471448 0.000000 4.478585 4.360506 5.008376 5.735530 3.560816 6.092641 2.214570 5.984572 5.581424 3.929551 3.472190 5.608285 4.784549 6.014893 5.944388 3.111579 3.341625 1.790814 2.155815 2.217127 6.915614 6.560635 6.391713 3.508751 4.349639 3.505429 4.190705 3.275551 4.785148 5.247416 4.465782 5.447824 5.224984 4.709600 6.087928 6.424576 6.555041 6.151666 0.984014 0.000000 5.692065 5.295103 6.352286 6.871250 4.865601 7.014481 2.307520 7.519954 7.084243 4.454527 3.852819 7.125638 5.342162 6.886312 6.968621 3.233763 3.819946 3.209799 3.645830 3.351176 8.206049 7.822823 7.761582 4.135907 5.090904 4.117299 5.523655 4.643331 6.172171 6.713662 5.910582 6.973687 6.618092 6.109591 7.443388 7.128255 7.336304 7.001452 0.965105 1.547858 0.000000 6.026127 7.225334 6.189028 6.381965 4.854439 3.178017 7.412498 5.017279 5.391513 5.985520 6.607624 5.131085 6.391893 2.786483 1.807439 7.734238 7.553652 4.318254 4.394457 3.994062 4.647339 5.244139 3.854952 4.162985 3.488784 4.680360 3.572290 3.598842 2.778465 2.729059 3.272389 3.361209 5.647926 4.871250 6.006623 7.041604 6.377412 6.825970 7.042899 6.072834 7.310735 0.000000 5.122689 6.362812 5.219915 5.507144 4.024149 3.218297 6.826818 4.104387 4.427407 5.503400 6.071188 4.280624 5.863920 3.080458 2.189529 7.111496 6.837985 3.824447 3.723738 3.640448 3.927724 4.440860 3.058612 4.058685 3.506383 4.421938 3.209967 3.162386 2.389823 1.751167 2.345138 2.398405 4.973192 4.275712 5.414206 6.445453 5.853113 6.125480 6.561571 5.598026 6.943026 0.985529 0.000000 6.300286 7.400225 6.437714 6.843306 5.049920 3.714804 7.239873 5.223247 5.616681 6.139898 6.672642 5.154638 6.673408 3.155638 2.253597 7.675260 7.563012 3.953113 4.229291 3.666349 5.416684 5.916762 4.586004 4.013709 3.475113 4.675308 2.978387 3.061735 2.318791 3.198040 3.610636 3.714261 5.356910 4.487541 5.689263 7.539703 6.938418 7.324530 6.648660 5.673694 6.856133 0.965088 1.551926 0.000000 4.441360 5.356861 5.442488 3.974330 3.688373 1.886646 6.087279 6.289522 5.974411 3.246455 4.175305 6.811599 3.000488 2.838933 3.248566 5.821769 5.648836 5.133201 4.659159 4.541853 2.781269 3.032786 3.021684 3.713787 3.203517 3.240726 6.511627 5.894911 6.034678 3.823599 3.495197 4.720689 7.884294 7.367782 8.619061 2.977519 2.106744 3.177446 6.828082 6.181601 7.123224 4.467432 4.117555 5.084824 0.000000 4.026076 5.112960 4.861404 3.437803 3.441908 2.394844 6.320551 5.580152 5.281621 3.732638 4.564529 6.195278 3.429091 3.316886 3.462323 6.055273 5.728227 5.202422 4.610715 4.766309 1.800584 2.155344 2.122057 4.275494 3.776059 3.835377 6.315389 5.782680 5.766441 3.248077 3.029566 4.074260 7.426680 6.993080 8.132150 3.097816 2.292450 3.027129 7.051312 6.366887 7.460403 4.318637 3.823413 5.026503 0.984490 0.000000 2.013418 2.604355 3.196502 2.644783 0.978846 3.994812 3.209061 4.841454 4.235104 1.873621 2.088793 5.082386 2.161525 4.470717 4.531608 3.080701 2.727501 2.907737 2.133873 2.796614 3.752562 3.291815 3.549796 3.138840 3.446816 2.474997 5.014924 4.177208 4.956544 3.363305 2.406661 3.857205 5.835584 5.453662 6.741511 3.226197 3.265195 2.840738 4.020884 3.481465 4.581854 5.037549 4.327465 5.231558 3.203953 3.203465 0.000000 3.855449 4.663828 4.952941 3.644679 2.963465 2.090843 5.134801 5.998854 5.615672 2.353857 3.269011 6.423117 2.274908 2.879662 3.271513 4.908343 4.778879 4.319015 3.847536 3.729923 3.105538 3.137062 3.178402 2.972819 2.664436 2.383862 5.983329 5.271569 5.628012 3.625406 3.084851 4.494554 7.363189 6.834428 8.151633 2.783031 2.136246 2.921432 5.872904 5.252420 6.169847 4.433714 4.010681 4.901993 0.967185 1.539481 2.349077 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8654,-1.4601,-1.4103;-1.614,-2.5947,-.9676;.2491,-1.9276,-2.1529;-1.7272,-.7394,-2.3245;-.4198,-.6318,-.3343;-.7576,3.6132,.7642;-1.6067,-2.7412,2.2894;2.8283,-.7742,-2.4795;1.9879,-1.2583,-2.4473;-2.605,.0529,1.359;-2.6424,-.9058,1.5792;3.403,-1.2231,-1.8207;-3.2258,.1851,.6149;-.1456,3.8413,1.4912;.751,3.6845,1.1236;-2.4309,-2.677,1.757;-2.1421,-2.7949,.8376;1.1457,-.6244,1.9696;.7308,-.7853,1.0973;.6354,.1463,2.3161;-.6945,1.9407,-2.7295;-1.0923,1.0559,-2.762;.1731,1.7816,-2.3011;-.5524,1.3845,2.787;-.3865,2.2589,2.3718;-1.3144,1.0156,2.3009;3.7256,.0258,1.2943;2.7959,-.1752,1.5541;3.6499,.7729,.6873;1.4851,1.2453,-1.1318;.8257,.6397,-.73;2.0927,.637,-1.6082;4.3971,-1.9404,-.5115;4.21,-1.2658,.1818;5.3386,-1.8512,-.7039;-3.9554,.6209,-1.0818;-3.5559,1.505,-1.0321;-3.3064,.1048,-1.5869;-.0816,-2.7591,3.2378;.3997,-1.992,2.8528;-.2643,-2.5091,4.1519;2.3872,3.2406,.4971;2.1349,2.465,-.0562;2.8486,2.872,1.2604;-1.9622,2.7184,-.3793;-1.5049,2.5106,-1.226;-1.1616,-.3244,.2256;-1.8335,1.9255,.1595; 0.2125080 0.1874234 0.1734444 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 592 RedAO= T EigKep= 8.02D-05 NBF= 592 NBsUse= 592 1.00D-06 EigRej= -1.00D+00 NBFU= 592 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 604 602 603 604 604 MxSgAt= 48 MxSgA2= 48. 1 Closed 1 1 1 -1471.49363816533 -1471.49363817 1 1.466649457256e+03 -7.677212935307e+03 2.651730171146e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 11324620800 LenX= 11323862024 LenY= 11323488092 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. PT238.700S Wed Nov 6 03:58:52 2024 -24.64590 -24.64474 -24.64198 -19.12476 -19.12381 -19.12195 -19.12145 -19.12124 -19.12092 -19.12072 -19.11964 -19.11944 -19.11907 -19.11568 -19.11514 -19.11267 -19.11122 -19.11056 -6.85377 -1.19700 -1.15522 -1.15205 -1.02637 -1.02121 -1.01977 -1.01521 -1.01326 -1.01162 -1.00963 -1.00793 -1.00529 -1.00068 -0.99843 -0.99466 -0.99385 -0.99130 -0.98674 -0.57672 -0.53933 -0.53903 -0.53431 -0.53240 -0.53180 -0.53075 -0.53005 -0.52889 -0.52829 -0.52724 -0.52507 -0.52357 -0.51863 -0.51550 -0.51132 -0.49745 -0.49255 -0.44175 -0.42821 -0.42523 -0.42465 -0.41924 -0.41632 -0.41482 -0.41173 -0.40810 -0.40762 -0.40032 -0.39929 -0.39491 -0.39198 -0.38885 -0.38285 -0.38016 -0.37708 -0.37387 -0.37057 -0.35527 -0.32871 -0.32463 -0.32403 -0.32316 -0.32247 -0.32114 -0.32064 -0.31918 -0.31841 -0.31769 -0.31548 -0.31503 -0.31286 -0.31187 -0.30989 -0.00582 0.01772 0.02374 0.02523 0.04810 0.05211 0.05795 0.06953 0.07668 0.08225 0.09125 0.09362 0.10159 0.10918 0.11302 0.11769 0.11795 0.12338 0.13587 0.13707 0.13991 0.14325 0.14742 0.15022 0.15104 0.15676 0.15891 0.16556 0.16907 0.17155 0.17376 0.17703 0.18229 0.18422 0.18738 0.19161 0.19393 0.19630 0.19846 0.20438 0.20638 0.20813 0.21419 0.21613 0.22293 0.22878 0.23051 0.23368 0.23810 0.24023 0.24427 0.24484 0.24794 0.25098 0.25435 0.25650 0.26046 0.26599 0.26706 0.27198 0.27395 0.27432 0.27531 0.27691 0.28261 0.28330 0.28570 0.28805 0.29260 0.29376 0.29880 0.30325 0.30386 0.30642 0.31559 0.31910 0.32579 0.33145 0.33772 0.34290 0.34529 0.35530 0.35879 0.36461 0.36883 0.37906 0.38263 0.39073 0.39574 0.40435 0.41826 0.42408 0.43565 0.44229 0.45895 0.46956 0.47665 0.48193 0.48875 0.49719 0.50514 0.51527 0.51613 0.52230 0.52570 0.53130 0.54374 0.54747 0.54927 0.55430 0.55598 0.56551 0.57163 0.57804 0.58050 0.58306 0.58557 0.59827 0.60013 0.60253 0.61149 0.61541 0.62124 0.63653 0.63816 0.64435 0.65268 0.65787 0.66707 0.67415 0.67478 0.67782 0.68525 0.69132 0.69678 0.70106 0.71959 0.72364 0.73419 0.75611 0.77813 0.83343 0.93755 0.94581 0.95873 0.96730 0.97770 0.98383 0.98683 0.99348 0.99515 1.00015 1.00246 1.00624 1.01332 1.02123 1.02330 1.02955 1.03034 1.03736 1.04153 1.04855 1.04976 1.06414 1.06582 1.06911 1.07796 1.08151 1.08711 1.09447 1.09949 1.10231 1.10920 1.11605 1.11869 1.12749 1.13072 1.14017 1.14362 1.14676 1.16213 1.16484 1.16992 1.18416 1.19850 1.21861 1.22626 1.23067 1.24598 1.26128 1.27174 1.27556 1.28204 1.28744 1.29166 1.30524 1.31217 1.31441 1.31980 1.32211 1.33354 1.33513 1.34057 1.34729 1.34831 1.35227 1.36103 1.36356 1.37011 1.37827 1.38202 1.38897 1.39836 1.40312 1.41052 1.41794 1.41969 1.42372 1.43321 1.44053 1.44644 1.44935 1.45365 1.46117 1.46784 1.47132 1.47487 1.47945 1.48993 1.49643 1.50239 1.50951 1.51690 1.51970 1.53299 1.53561 1.54326 1.55394 1.56092 1.57701 1.58670 1.58737 1.59979 1.60872 1.60949 1.62190 1.62759 1.63488 1.64043 1.65413 1.66185 1.67390 1.68512 1.69147 1.69648 1.70691 1.71554 1.72444 1.73384 1.74550 1.75236 1.75565 1.75653 1.77431 1.77764 1.79540 1.80225 1.80992 1.81436 1.83812 1.84321 1.86109 1.87155 1.93232 2.02886 2.03354 2.04100 2.05982 2.08778 2.11131 2.11370 2.12786 2.16266 2.19206 2.19813 2.21815 2.23431 2.25292 2.25858 2.28009 2.29720 2.30711 2.31455 2.31854 2.33389 2.34783 2.35362 2.37041 2.38852 2.39461 2.41260 2.41356 2.42090 2.43843 2.44333 2.46253 2.49670 2.52238 2.57379 2.60250 2.60325 2.61932 2.64247 2.66200 2.69431 2.69888 2.70695 2.71519 2.72166 2.73177 2.74069 2.74980 2.75119 2.75776 2.77251 2.78192 2.78518 2.78896 2.80968 2.81222 2.82118 2.82764 2.84186 2.85310 2.87142 2.88551 2.88897 2.97736 3.07198 3.07834 3.08005 3.08138 3.09674 3.09776 3.10113 3.10561 3.11179 3.11523 3.11794 3.12707 3.13076 3.13520 3.14172 3.14331 3.15389 3.15469 3.15897 3.16117 3.16635 3.17195 3.17505 3.17950 3.18179 3.18661 3.19907 3.20628 3.21569 3.23402 3.28720 3.29935 3.30546 3.31536 3.32294 3.32982 3.33571 3.34448 3.35023 3.35500 3.36205 3.37250 3.39228 3.39771 3.40575 3.57961 3.69489 3.70050 3.71291 3.71845 3.72155 3.72762 3.73653 3.74069 3.75144 3.76341 3.77130 3.78336 3.80109 3.80672 3.81590 3.82586 3.83058 3.84068 3.84739 3.87229 3.89147 3.90970 3.91280 3.91736 3.91891 3.93672 3.94069 3.94245 3.94684 3.94967 3.95688 3.96344 3.96483 3.96783 3.98041 3.98640 4.00536 4.00945 4.10124 4.20800 4.23379 4.40870 4.65023 4.67396 5.00998 5.01764 5.02560 5.02919 5.04091 5.04689 5.05663 5.06024 5.06343 5.07376 5.11243 5.13280 5.18905 5.20801 5.26353 5.35245 5.37101 5.37959 5.39039 5.39918 5.40684 5.42986 5.43503 5.43820 5.44862 5.45363 5.48221 5.52527 5.53478 5.54484 5.65235 5.66378 5.66772 5.68194 5.68937 5.69405 5.70052 5.70683 5.71252 5.71942 5.72169 5.74410 5.75775 5.78717 5.82210 6.35016 6.36990 6.43496 6.43802 6.45863 6.47999 6.51383 6.65518 6.70088 14.59496 49.88161 49.89515 49.89722 49.90618 49.91575 49.92086 49.92860 49.93298 49.93665 49.94051 49.95197 49.96912 49.97858 49.99012 49.99646 66.84919 66.86491 66.87542 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.159790 -0.476279 -0.453495 -0.502663 -1.059451 0.372552 0.415439 -0.778955 0.333989 -0.858684 0.418544 0.434348 0.383889 -0.804756 0.410609 -0.738325 0.321655 -0.799856 0.408340 0.417048 -0.683208 0.300730 0.363149 -0.815145 0.434217 0.373366 -0.665644 0.391085 0.283580 -0.840782 0.426879 0.427239 -0.762358 0.415806 0.322826 -0.681449 0.340470 0.332111 -0.729961 0.397725 0.312045 -0.701793 0.391846 0.302608 -0.715807 0.401702 0.458382 0.316643 -1.00000 5.3053 0.3176 2.6528 5.9401 -156.8445 -194.6569 -164.2704 -0.2669 1.8025 -4.7386 15.0794 -22.7330 7.6535 -0.2669 1.8025 -4.7386 177.2296 -83.2513 65.4616 17.4629 13.5521 -10.6152 -6.1919 -35.8135 -36.9437 6.8682 -3884.8313 -4067.7203 -2675.3135 -102.5290 -145.2055 -55.4038 -19.9558 74.6271 -117.2806 -1360.2344 -1283.3050 -1159.4115 106.4412 54.3290 56.8272 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) GINC-GARGANTA LAMSABHI 06-Nov-2024 0 Wavefunction 14H2OBF3OHCONF223 water -1 1 Version=EM64L-G16RevC.01 State=1-A HF=-1471.4936382 RMSD=8.633e-10 Dipole=0.6051535,-2.22328,-0.3904494 Quadrupole=-2.70461,10.608936,-7.9043259,-2.6369108,10.9404347,4.2770064 PG=C01 [X(B1F3H29O15)] 0 -1.7708861513 0.8936443498 0.9459588508 0 -1.8123451151 1.1958349741 2.3426028916 0 -2.8226451168 -0.0135527588 0.6580628394 0 -2.0628756158 2.1330188476 0.2558244551 0 -0.5213250062 0.3362909996 0.5329712914 0 2.5299470001 1.2615843294 -2.4959322225 0 0.9140752783 0.1550594042 3.7962034082 0 -2.9810259215 -2.0402736531 -1.3311224956 0 -3.0454825846 -1.3812938235 -0.6217153668 0 1.6327458308 1.9900851199 1.3908701812 0 1.3651194081 1.7422660598 2.3052331736 0 -2.7286875767 -2.8747991695 -0.8776129318 0 1.1619482407 2.822553489 1.1863373112 0 3.1615995194 0.5232416829 -2.6002523678 0 2.6188008522 -0.228121224 -2.9234706327 0 0.6266868032 1.0953311369 3.8050573653 0 -0.2689462601 1.084490042 3.4304274928 0 1.1977481305 -1.8181366365 0.9352877115 0 0.4405659301 -1.2023224043 0.8561733925 0 1.9538061511 -1.280162675 0.5986695795 0 -1.2904208046 1.9026782264 -2.5305291992 0 -1.6786290169 2.0823949366 -1.6593066885 0 -1.1454700591 0.9329031082 -2.516406414 0 3.1568166218 -0.0490573145 0.1480697455 0 3.194459269 0.1209063478 -0.8184971443 0 2.6893727666 0.7224528861 0.5212261898 0 0.4966853417 -3.8510025392 -0.7707343796 0 0.7795272315 -3.1160537835 -0.1774038049 0 0.3487011731 -3.4270628332 -1.6255551515 0 -0.6210016981 -0.7600329559 -2.0315083676 0 -0.4571511068 -0.4093395368 -1.1296796481 0 -1.426713566 -1.3117669616 -1.9185385654 0 -2.1178905448 -4.3573000875 -0.073856725 0 -1.1648218214 -4.2462923539 -0.2975795867 0 -2.398910018 -5.1489318938 -0.5489634817 0 0.0377115954 4.1164953483 0.3721519557 0 0.440049208 3.929732574 -0.4920877875 0 -0.7550851096 3.5559775361 0.3812251473 0 1.4631675527 -1.55101932 3.679342877 0 1.4218035372 -1.7059620685 2.7084853018 0 2.4001214428 -1.6069621289 3.9038750892 0 1.5901869182 -1.6482301911 -3.3617392085 0 0.7827426471 -1.4184362068 -2.8455065383 0 1.9902328985 -2.3920948957 -2.8948094613 0 1.3183319456 2.5267844417 -1.7954393372 0 0.4133407456 2.3176279909 -2.1217293183 0 0.2332641701 0.9190298157 0.7546715377 0 1.3766351613 2.0646171111 -0.9478252319 Gaussian 16 6-Nov-2024 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 138 C1[X(BF3H29O15)] RB3LYP 6-311+G(d,p) SP #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read pop=nbo7read 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; oldchk=/home/lamsabhi/diver/BF3-H2O/14H2OBF3OH/water/CONF223/opt-b3lyp.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Wate 1/29=2,38=1,163=2,172=1/1 2/12=2,40=1/2 3/5=4,6=6,7=111,11=2,14=-4,25=1,30=1,70=32201,72=1,74=-5,116=-2,124=41/1,2,3 4/5=1/1 5/5=2,38=6,53=1/2 6/7=2,8=2,9=2,10=2,28=1,40=2,113=1,114=1,124=2103/1,12 99/5=1,9=1/99 Wavefunction 14H2OBF3OH CONF223 water Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 11 19 19 19 16 1 1 16 1 16 1 1 1 16 1 16 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 1 11.0093053 18.9984033 18.9984033 18.9984033 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 3 1 1 1 0 1 1 0 1 0 1 1 1 0 1 0 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 1 2.7500000 6.7500000 6.7500000 6.7500000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) 6-311+G(d,p) (5D, 7F) 0.10000e-02 0.10000e-05 F 611 A 592 A 592 916 611 91 91 2087.3848596532 48 48 48 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=141 Grimme-D3(BJ) -0.0589086310 PCM SMD-Coulomb. Total charges None On-the-fly selection Water 78.355300 1.777849 0.000000 1.429564 0.000000 1.418481 2.306729 0.000000 1.448307 2.301244 2.312318 0.000000 1.429197 2.383341 2.331118 2.383573 0.000000 5.520793 6.501634 6.342232 5.424535 4.397805 0.000000 3.984773 3.260297 4.882564 5.030790 3.569580 6.589872 0.000000 3.906074 5.033336 2.844212 4.558264 3.895258 6.529155 6.802997 0.000000 3.042621 4.116965 1.886320 3.753130 3.264165 6.448481 6.128335 0.970396 0.000000 3.603448 3.661322 4.939846 3.868640 2.847990 4.054987 3.109571 6.703725 6.107579 0.000000 3.521692 3.224324 4.830470 4.012968 2.945565 4.963776 2.223884 6.813198 6.146305 0.984428 0.000000 4.294644 5.270630 3.248670 5.177473 4.144068 6.883449 6.655398 0.982740 1.548031 6.916301 6.943130 0.000000 3.518521 3.581841 4.919305 3.426485 3.072751 4.226956 3.740103 6.866508 6.216419 0.978002 1.568511 7.201164 0.000000 6.086233 7.044453 6.834907 6.167957 4.839005 0.977250 6.789814 6.775998 6.787469 4.518637 5.364434 7.014959 4.860422 0.000000 5.958204 7.028103 6.517880 6.131965 4.703822 1.552387 6.943121 6.097338 6.221896 4.950382 5.726560 6.307620 5.321612 0.981655 0.000000 3.736774 2.845655 4.799072 4.572482 3.549735 6.584262 0.983250 7.016263 6.262173 2.764243 1.792562 6.996276 3.182373 6.912385 7.140948 0.000000 2.909438 1.891518 3.925950 3.794167 3.003123 6.556440 1.548281 6.308081 5.496281 2.931950 2.090192 6.347087 3.178721 6.960801 7.101694 0.970888 0.000000 4.020778 4.486114 4.415534 5.167685 2.785432 4.799240 3.486949 4.759003 4.540936 3.859965 3.818538 4.451971 4.647614 4.673201 4.408804 4.129163 4.099043 0.000000 3.048222 3.610573 3.478644 4.213329 1.843102 4.655423 3.272686 4.146531 3.790609 3.449443 3.409571 3.980874 4.102320 4.725301 4.469842 3.742963 3.515637 0.979189 0.000000 4.326590 4.832780 4.941894 5.282148 2.956943 4.045859 3.655834 5.352984 5.147082 3.380116 3.520509 5.162172 4.219558 3.865764 3.735570 4.205370 4.307095 0.987092 1.536966 0.000000 3.651707 4.951712 4.023279 2.900605 3.525636 3.873940 6.923982 4.454615 4.184290 4.891821 5.519259 5.255952 4.547019 4.661351 4.469533 6.668341 6.102938 5.661037 4.909898 5.517914 0.000000 2.865144 4.101116 3.327457 1.953954 3.032213 4.368728 6.340294 4.335936 3.865491 4.503033 5.009757 5.127128 4.088325 5.171475 5.040288 6.012325 5.374794 5.497237 4.648440 5.440573 0.970584 0.000000 3.518616 4.911601 3.712944 3.157083 3.169260 3.690141 6.685493 3.689708 3.543361 4.909473 5.496029 4.437434 4.754500 4.327320 3.960229 6.567178 6.012995 4.997308 4.295229 4.920048 0.980650 1.529774 0.000000 5.080115 5.572997 6.001276 5.658468 3.718248 3.016868 4.287241 6.620126 6.390300 2.832922 3.327517 6.608782 3.647417 2.807280 3.123441 4.591812 4.877976 2.754506 3.034707 1.779296 5.546358 5.584911 5.154935 0.000000 5.325888 6.017983 6.197084 5.730823 3.959787 2.134599 5.147502 6.562782 6.421231 3.288477 3.966482 6.637877 3.930567 1.826911 2.210004 5.377752 5.565701 3.289757 3.484162 2.347462 5.120538 5.319905 4.730457 0.982118 0.000000 4.483705 4.879238 5.562623 4.964272 3.233858 3.069092 3.768168 6.573985 6.214550 1.865377 2.444657 6.652244 2.680638 3.163275 3.574144 3.895800 4.164874 2.975061 2.978940 2.134836 5.152174 5.067900 4.896685 0.976206 1.553007 0.000000 5.531780 6.363573 5.271189 6.588906 4.502157 5.766195 6.089308 3.960713 4.320720 6.330993 6.442081 3.371561 6.986348 5.439018 4.718360 6.739509 6.526488 2.744912 3.108936 3.256944 6.276581 6.381752 5.350682 4.730252 4.801700 5.233883 0.000000 4.883056 5.626777 4.826921 5.984956 3.757065 5.253880 5.148576 4.078006 4.223447 5.409262 5.487228 3.585536 6.105169 4.978849 4.389073 5.798200 5.635629 1.759994 2.201260 2.313378 5.916887 5.938218 5.056738 3.894086 4.089108 4.343930 0.985997 0.000000 5.456542 6.464332 5.188873 6.345849 4.424818 5.243930 6.522784 3.618972 4.088196 6.331910 6.573140 3.214768 6.901146 4.946447 4.131727 7.072544 6.804304 3.141248 3.334199 3.483205 5.649056 5.870718 4.694195 4.737318 4.619282 5.225504 0.965579 1.542556 0.000000 3.594745 4.937364 3.555033 3.959879 2.790774 3.772414 6.095579 2.774756 2.872558 4.935099 5.386419 3.200945 5.135014 4.034642 3.402183 6.250168 5.775721 3.637212 3.108255 3.717258 2.790551 3.055570 1.837451 4.419045 4.099414 4.435403 3.520351 3.309081 2.866735 0.000000 2.780637 4.058310 2.991360 3.310825 1.823319 3.685293 5.144233 3.011722 2.811082 4.059320 4.443951 3.361831 4.293082 4.015924 3.565390 5.271657 4.802242 2.997914 2.319123 3.091640 2.828806 2.825111 2.049002 3.850092 3.703006 3.729217 3.589386 3.124501 3.162585 0.981391 0.000000 3.631479 4.959244 3.205130 4.122997 3.089616 4.755069 6.347373 1.814295 2.075331 5.587012 5.912842 2.285111 5.782217 4.988447 4.307013 6.539887 5.974438 3.910055 3.346302 4.214884 3.275022 3.413356 2.339891 5.184019 4.961641 5.199295 3.385947 3.339835 2.777123 0.983028 1.541663 0.000000 5.360303 6.063823 4.461001 6.498920 4.994703 7.683795 6.673198 2.773866 3.164994 7.516781 7.415938 1.793574 7.993480 7.620720 6.899758 7.232556 6.731395 4.296415 4.167078 5.147794 6.775491 6.646523 5.907444 6.814158 6.987838 7.019102 2.752814 3.153798 3.058951 4.360437 4.411259 3.627099 0.000000 5.322842 6.083305 4.645182 6.465939 4.701486 6.987187 6.360249 3.038639 3.442407 7.040572 7.002719 2.159423 7.588442 6.838763 6.112021 6.969510 6.566420 3.605224 3.629624 4.396252 6.543063 6.493888 5.634504 6.040856 6.192504 6.341426 1.772212 2.252193 2.173800 3.931444 3.989410 3.362668 0.985249 0.000000 6.256352 6.997234 5.292314 7.333990 5.897760 8.317394 7.615029 3.257973 3.823408 8.425127 8.354817 2.321302 8.901436 8.203695 7.418226 8.191615 7.695963 5.121831 5.060905 5.935535 7.408141 7.351446 6.513882 7.573683 7.689579 7.842773 3.180924 3.791189 3.416614 4.961989 5.154745 4.188644 0.965080 1.549492 0.000000 3.739926 3.979402 5.031966 2.891397 3.824700 4.752648 5.308966 7.065389 6.381187 2.846672 3.337031 7.621881 1.897654 5.612961 6.033145 4.610766 4.317423 6.073110 5.355968 5.731199 3.884647 3.348166 4.458581 5.208729 5.229477 4.309647 8.062126 7.291232 7.809790 5.476497 4.794118 6.071065 8.755042 8.475308 9.624641 0.000000 4.021697 4.536843 5.245714 3.170518 3.858472 3.937268 5.732565 6.931718 6.353954 2.954706 3.669573 7.516061 2.136374 4.843075 5.286429 5.151128 4.897367 5.970721 5.306204 5.533915 3.355401 3.043658 3.948762 4.860185 4.711738 4.046345 7.785929 7.060976 7.444161 5.048717 4.476498 5.743943 8.682908 8.334316 9.512364 0.971425 0.000000 2.904960 3.245778 4.134367 1.936712 3.231726 4.932921 5.100433 6.261388 5.534298 3.028719 3.389192 6.843586 2.204798 5.781619 6.051737 4.436970 3.955024 5.744706 4.929156 5.547398 3.390914 2.681072 3.928001 5.324811 5.370098 4.462371 7.599822 6.868996 7.349038 4.946434 4.253861 5.425397 8.042655 7.842453 8.907461 0.970973 1.526668 0.000000 4.889465 4.478958 5.464442 6.142117 4.171307 6.868972 1.796069 6.715280 6.233445 4.219631 3.569807 6.331658 5.043208 6.827924 6.832473 2.778250 3.163556 2.769772 3.022845 3.131236 7.620550 7.181488 7.166741 4.194547 5.101301 4.079946 5.101686 4.217961 5.736159 6.130517 5.302618 6.304358 5.897940 5.476015 6.763076 6.714921 6.963207 6.471448 0.000000 4.478585 4.360506 5.008376 5.735530 3.560816 6.092641 2.214570 5.984572 5.581424 3.929551 3.472190 5.608285 4.784549 6.014893 5.944388 3.111579 3.341625 1.790814 2.155815 2.217127 6.915614 6.560635 6.391713 3.508751 4.349639 3.505429 4.190705 3.275551 4.785148 5.247416 4.465782 5.447824 5.224984 4.709600 6.087928 6.424576 6.555041 6.151666 0.984014 0.000000 5.692065 5.295103 6.352286 6.871250 4.865601 7.014481 2.307520 7.519954 7.084243 4.454527 3.852819 7.125638 5.342162 6.886312 6.968621 3.233763 3.819946 3.209799 3.645830 3.351176 8.206049 7.822823 7.761582 4.135907 5.090904 4.117299 5.523655 4.643331 6.172171 6.713662 5.910582 6.973687 6.618092 6.109591 7.443388 7.128255 7.336304 7.001452 0.965105 1.547858 0.000000 6.026127 7.225334 6.189028 6.381965 4.854439 3.178017 7.412498 5.017279 5.391513 5.985520 6.607624 5.131085 6.391893 2.786483 1.807439 7.734238 7.553652 4.318254 4.394457 3.994062 4.647339 5.244139 3.854952 4.162985 3.488784 4.680360 3.572290 3.598842 2.778465 2.729059 3.272389 3.361209 5.647926 4.871250 6.006623 7.041604 6.377412 6.825970 7.042899 6.072834 7.310735 0.000000 5.122689 6.362812 5.219915 5.507144 4.024149 3.218297 6.826818 4.104387 4.427407 5.503400 6.071188 4.280624 5.863920 3.080458 2.189529 7.111496 6.837985 3.824447 3.723738 3.640448 3.927724 4.440860 3.058612 4.058685 3.506383 4.421938 3.209967 3.162386 2.389823 1.751167 2.345138 2.398405 4.973192 4.275712 5.414206 6.445453 5.853113 6.125480 6.561571 5.598026 6.943026 0.985529 0.000000 6.300286 7.400225 6.437714 6.843306 5.049920 3.714804 7.239873 5.223247 5.616681 6.139898 6.672642 5.154638 6.673408 3.155638 2.253597 7.675260 7.563012 3.953113 4.229291 3.666349 5.416684 5.916762 4.586004 4.013709 3.475113 4.675308 2.978387 3.061735 2.318791 3.198040 3.610636 3.714261 5.356910 4.487541 5.689263 7.539703 6.938418 7.324530 6.648660 5.673694 6.856133 0.965088 1.551926 0.000000 4.441360 5.356861 5.442488 3.974330 3.688373 1.886646 6.087279 6.289522 5.974411 3.246455 4.175305 6.811599 3.000488 2.838933 3.248566 5.821769 5.648836 5.133201 4.659159 4.541853 2.781269 3.032786 3.021684 3.713787 3.203517 3.240726 6.511627 5.894911 6.034678 3.823599 3.495197 4.720689 7.884294 7.367782 8.619061 2.977519 2.106744 3.177446 6.828082 6.181601 7.123224 4.467432 4.117555 5.084824 0.000000 4.026076 5.112960 4.861404 3.437803 3.441908 2.394844 6.320551 5.580152 5.281621 3.732638 4.564529 6.195278 3.429091 3.316886 3.462323 6.055273 5.728227 5.202422 4.610715 4.766309 1.800584 2.155344 2.122057 4.275494 3.776059 3.835377 6.315389 5.782680 5.766441 3.248077 3.029566 4.074260 7.426680 6.993080 8.132150 3.097816 2.292450 3.027129 7.051312 6.366887 7.460403 4.318637 3.823413 5.026503 0.984490 0.000000 2.013418 2.604355 3.196502 2.644783 0.978846 3.994812 3.209061 4.841454 4.235104 1.873621 2.088793 5.082386 2.161525 4.470717 4.531608 3.080701 2.727501 2.907737 2.133873 2.796614 3.752562 3.291815 3.549796 3.138840 3.446816 2.474997 5.014924 4.177208 4.956544 3.363305 2.406661 3.857205 5.835584 5.453662 6.741511 3.226197 3.265195 2.840738 4.020884 3.481465 4.581854 5.037549 4.327465 5.231558 3.203953 3.203465 0.000000 3.855449 4.663828 4.952941 3.644679 2.963465 2.090843 5.134801 5.998854 5.615672 2.353857 3.269011 6.423117 2.274908 2.879662 3.271513 4.908343 4.778879 4.319015 3.847536 3.729923 3.105538 3.137062 3.178402 2.972819 2.664436 2.383862 5.983329 5.271569 5.628012 3.625406 3.084851 4.494554 7.363189 6.834428 8.151633 2.783031 2.136246 2.921432 5.872904 5.252420 6.169847 4.433714 4.010681 4.901993 0.967185 1.539481 2.349077 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8654,-1.4601,-1.4103;-1.614,-2.5947,-.9676;.2491,-1.9276,-2.1529;-1.7272,-.7394,-2.3245;-.4198,-.6318,-.3343;-.7576,3.6132,.7642;-1.6067,-2.7412,2.2894;2.8283,-.7742,-2.4795;1.9879,-1.2583,-2.4473;-2.605,.0529,1.359;-2.6424,-.9058,1.5792;3.403,-1.2231,-1.8207;-3.2258,.1851,.6149;-.1456,3.8413,1.4912;.751,3.6845,1.1236;-2.4309,-2.677,1.757;-2.1421,-2.7949,.8376;1.1457,-.6244,1.9696;.7308,-.7853,1.0973;.6354,.1463,2.3161;-.6945,1.9407,-2.7295;-1.0923,1.0559,-2.762;.1731,1.7816,-2.3011;-.5524,1.3845,2.787;-.3865,2.2589,2.3718;-1.3144,1.0156,2.3009;3.7256,.0258,1.2943;2.7959,-.1752,1.5541;3.6499,.7729,.6873;1.4851,1.2453,-1.1318;.8257,.6397,-.73;2.0927,.637,-1.6082;4.3971,-1.9404,-.5115;4.21,-1.2658,.1818;5.3386,-1.8512,-.7039;-3.9554,.6209,-1.0818;-3.5559,1.505,-1.0321;-3.3064,.1048,-1.5869;-.0816,-2.7591,3.2378;.3997,-1.992,2.8528;-.2643,-2.5091,4.1519;2.3872,3.2406,.4971;2.1349,2.465,-.0562;2.8486,2.872,1.2604;-1.9622,2.7184,-.3793;-1.5049,2.5106,-1.226;-1.1616,-.3244,.2256;-1.8335,1.9255,.1595; 0.2125080 0.1874234 0.1734444 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 592 RedAO= T EigKep= 8.02D-05 NBF= 592 NBsUse= 592 1.00D-06 EigRej= -1.00D+00 NBFU= 592 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 604 602 603 604 604 MxSgAt= 48 MxSgA2= 48. 1 Closed 1 1 1 -1471.49363816533 -1471.49363817 1 1.466649457256e+03 -7.677212935307e+03 2.651730171146e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 11324620800 LenX= 11323862024 LenY= 11323488092 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. PT30283.600S Wed Nov 6 05:11:01 2024 -24.64590 -24.64474 -24.64198 -19.12476 -19.12381 -19.12195 -19.12145 -19.12124 -19.12092 -19.12072 -19.11964 -19.11944 -19.11907 -19.11568 -19.11514 -19.11267 -19.11122 -19.11056 -6.85377 -1.19700 -1.15522 -1.15205 -1.02637 -1.02121 -1.01977 -1.01521 -1.01326 -1.01162 -1.00963 -1.00793 -1.00529 -1.00068 -0.99843 -0.99466 -0.99385 -0.99130 -0.98674 -0.57672 -0.53933 -0.53903 -0.53431 -0.53240 -0.53180 -0.53075 -0.53005 -0.52889 -0.52829 -0.52724 -0.52507 -0.52357 -0.51863 -0.51550 -0.51132 -0.49745 -0.49255 -0.44175 -0.42821 -0.42523 -0.42465 -0.41924 -0.41632 -0.41482 -0.41173 -0.40810 -0.40762 -0.40032 -0.39929 -0.39491 -0.39198 -0.38885 -0.38285 -0.38016 -0.37708 -0.37387 -0.37057 -0.35527 -0.32871 -0.32463 -0.32403 -0.32316 -0.32247 -0.32114 -0.32064 -0.31918 -0.31841 -0.31769 -0.31548 -0.31503 -0.31286 -0.31187 -0.30989 -0.00582 0.01772 0.02374 0.02523 0.04810 0.05211 0.05795 0.06953 0.07668 0.08225 0.09125 0.09362 0.10159 0.10918 0.11302 0.11769 0.11795 0.12338 0.13587 0.13707 0.13991 0.14325 0.14742 0.15022 0.15104 0.15676 0.15891 0.16556 0.16907 0.17155 0.17376 0.17703 0.18229 0.18422 0.18738 0.19161 0.19393 0.19630 0.19846 0.20438 0.20638 0.20813 0.21419 0.21613 0.22293 0.22878 0.23051 0.23368 0.23810 0.24023 0.24427 0.24484 0.24794 0.25098 0.25435 0.25650 0.26046 0.26599 0.26706 0.27198 0.27395 0.27432 0.27531 0.27691 0.28261 0.28330 0.28570 0.28805 0.29260 0.29376 0.29880 0.30325 0.30386 0.30642 0.31559 0.31910 0.32579 0.33145 0.33772 0.34290 0.34529 0.35530 0.35879 0.36461 0.36883 0.37906 0.38263 0.39073 0.39574 0.40435 0.41826 0.42408 0.43565 0.44229 0.45895 0.46956 0.47665 0.48193 0.48875 0.49719 0.50514 0.51527 0.51613 0.52230 0.52570 0.53130 0.54374 0.54747 0.54927 0.55430 0.55598 0.56551 0.57163 0.57804 0.58050 0.58306 0.58557 0.59827 0.60013 0.60253 0.61149 0.61541 0.62124 0.63653 0.63816 0.64435 0.65268 0.65787 0.66707 0.67415 0.67478 0.67782 0.68525 0.69132 0.69678 0.70106 0.71959 0.72364 0.73419 0.75611 0.77813 0.83343 0.93755 0.94581 0.95873 0.96730 0.97770 0.98383 0.98683 0.99348 0.99515 1.00015 1.00246 1.00624 1.01332 1.02123 1.02330 1.02955 1.03034 1.03736 1.04153 1.04855 1.04976 1.06414 1.06582 1.06911 1.07796 1.08151 1.08711 1.09447 1.09949 1.10231 1.10920 1.11605 1.11869 1.12749 1.13072 1.14017 1.14362 1.14676 1.16213 1.16484 1.16992 1.18416 1.19850 1.21861 1.22626 1.23067 1.24598 1.26128 1.27174 1.27556 1.28204 1.28744 1.29166 1.30524 1.31217 1.31441 1.31980 1.32211 1.33354 1.33513 1.34057 1.34729 1.34831 1.35227 1.36103 1.36356 1.37011 1.37827 1.38202 1.38897 1.39836 1.40312 1.41052 1.41794 1.41969 1.42372 1.43321 1.44053 1.44644 1.44935 1.45365 1.46117 1.46784 1.47132 1.47487 1.47945 1.48993 1.49643 1.50239 1.50951 1.51690 1.51970 1.53299 1.53561 1.54326 1.55394 1.56092 1.57701 1.58670 1.58737 1.59979 1.60872 1.60949 1.62190 1.62759 1.63488 1.64043 1.65413 1.66185 1.67390 1.68512 1.69147 1.69648 1.70691 1.71554 1.72444 1.73384 1.74550 1.75236 1.75565 1.75653 1.77431 1.77764 1.79540 1.80225 1.80992 1.81436 1.83812 1.84321 1.86109 1.87155 1.93232 2.02886 2.03354 2.04100 2.05982 2.08778 2.11131 2.11370 2.12786 2.16266 2.19206 2.19813 2.21815 2.23431 2.25292 2.25858 2.28009 2.29720 2.30711 2.31455 2.31854 2.33389 2.34783 2.35362 2.37041 2.38852 2.39461 2.41260 2.41356 2.42090 2.43843 2.44333 2.46253 2.49670 2.52238 2.57379 2.60250 2.60325 2.61932 2.64247 2.66200 2.69431 2.69888 2.70695 2.71519 2.72166 2.73177 2.74069 2.74980 2.75119 2.75776 2.77251 2.78192 2.78518 2.78896 2.80968 2.81222 2.82118 2.82764 2.84186 2.85310 2.87142 2.88551 2.88897 2.97736 3.07198 3.07834 3.08005 3.08138 3.09674 3.09776 3.10113 3.10561 3.11179 3.11523 3.11794 3.12707 3.13076 3.13520 3.14172 3.14331 3.15389 3.15469 3.15897 3.16117 3.16635 3.17195 3.17505 3.17950 3.18179 3.18661 3.19907 3.20628 3.21569 3.23402 3.28720 3.29935 3.30546 3.31536 3.32294 3.32982 3.33571 3.34448 3.35023 3.35500 3.36205 3.37250 3.39228 3.39771 3.40575 3.57961 3.69489 3.70050 3.71291 3.71845 3.72155 3.72762 3.73653 3.74069 3.75144 3.76341 3.77130 3.78336 3.80109 3.80672 3.81590 3.82586 3.83058 3.84068 3.84739 3.87229 3.89147 3.90970 3.91280 3.91736 3.91891 3.93672 3.94069 3.94245 3.94684 3.94967 3.95688 3.96344 3.96483 3.96783 3.98041 3.98640 4.00536 4.00945 4.10124 4.20800 4.23379 4.40870 4.65023 4.67396 5.00998 5.01764 5.02560 5.02919 5.04091 5.04689 5.05663 5.06024 5.06343 5.07376 5.11243 5.13280 5.18905 5.20801 5.26353 5.35245 5.37101 5.37959 5.39039 5.39918 5.40684 5.42986 5.43503 5.43820 5.44862 5.45363 5.48221 5.52527 5.53478 5.54484 5.65235 5.66378 5.66772 5.68194 5.68937 5.69405 5.70052 5.70683 5.71252 5.71942 5.72169 5.74410 5.75775 5.78717 5.82210 6.35016 6.36990 6.43496 6.43802 6.45863 6.47999 6.51383 6.65518 6.70088 14.59496 49.88161 49.89515 49.89722 49.90618 49.91575 49.92086 49.92860 49.93298 49.93665 49.94051 49.95197 49.96912 49.97858 49.99012 49.99646 66.84919 66.86491 66.87542 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.159790 -0.476279 -0.453495 -0.502663 -1.059451 0.372552 0.415439 -0.778955 0.333989 -0.858684 0.418544 0.434348 0.383889 -0.804756 0.410609 -0.738325 0.321655 -0.799856 0.408340 0.417048 -0.683208 0.300730 0.363149 -0.815145 0.434217 0.373366 -0.665644 0.391085 0.283580 -0.840782 0.426879 0.427239 -0.762358 0.415806 0.322826 -0.681449 0.340470 0.332111 -0.729961 0.397725 0.312045 -0.701793 0.391846 0.302608 -0.715807 0.401702 0.458382 0.316643 -1.00000 5.3053 0.3176 2.6528 5.9401 -156.8445 -194.6569 -164.2704 -0.2669 1.8025 -4.7386 15.0794 -22.7330 7.6535 -0.2669 1.8025 -4.7386 177.2296 -83.2513 65.4616 17.4629 13.5521 -10.6152 -6.1919 -35.8135 -36.9437 6.8682 -3884.8313 -4067.7203 -2675.3135 -102.5290 -145.2055 -55.4038 -19.9558 74.6271 -117.2806 -1360.2344 -1283.3050 -1159.4115 106.4412 54.3290 56.8272 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) GINC-GARGANTA LAMSABHI 06-Nov-2024 0 Wavefunction 14H2OBF3OH CONF223 water -1 1 Version=EM64L-G16RevC.01 State=1-A HF=-1471.4936382 RMSD=8.633e-10 Dipole=0.6051535,-2.22328,-0.3904494 Quadrupole=-2.70461,10.608936,-7.9043259,-2.6369108,10.9404347,4.2770064 PG=C01 [X(B1F3H29O15)] 0 -1.7708861513 0.8936443498 0.9459588508 0 -1.8123451151 1.1958349741 2.3426028916 0 -2.8226451168 -0.0135527588 0.6580628394 0 -2.0628756158 2.1330188476 0.2558244551 0 -0.5213250062 0.3362909996 0.5329712914 0 2.5299470001 1.2615843294 -2.4959322225 0 0.9140752783 0.1550594042 3.7962034082 0 -2.9810259215 -2.0402736531 -1.3311224956 0 -3.0454825846 -1.3812938235 -0.6217153668 0 1.6327458308 1.9900851199 1.3908701812 0 1.3651194081 1.7422660598 2.3052331736 0 -2.7286875767 -2.8747991695 -0.8776129318 0 1.1619482407 2.822553489 1.1863373112 0 3.1615995194 0.5232416829 -2.6002523678 0 2.6188008522 -0.228121224 -2.9234706327 0 0.6266868032 1.0953311369 3.8050573653 0 -0.2689462601 1.084490042 3.4304274928 0 1.1977481305 -1.8181366365 0.9352877115 0 0.4405659301 -1.2023224043 0.8561733925 0 1.9538061511 -1.280162675 0.5986695795 0 -1.2904208046 1.9026782264 -2.5305291992 0 -1.6786290169 2.0823949366 -1.6593066885 0 -1.1454700591 0.9329031082 -2.516406414 0 3.1568166218 -0.0490573145 0.1480697455 0 3.194459269 0.1209063478 -0.8184971443 0 2.6893727666 0.7224528861 0.5212261898 0 0.4966853417 -3.8510025392 -0.7707343796 0 0.7795272315 -3.1160537835 -0.1774038049 0 0.3487011731 -3.4270628332 -1.6255551515 0 -0.6210016981 -0.7600329559 -2.0315083676 0 -0.4571511068 -0.4093395368 -1.1296796481 0 -1.426713566 -1.3117669616 -1.9185385654 0 -2.1178905448 -4.3573000875 -0.073856725 0 -1.1648218214 -4.2462923539 -0.2975795867 0 -2.398910018 -5.1489318938 -0.5489634817 0 0.0377115954 4.1164953483 0.3721519557 0 0.440049208 3.929732574 -0.4920877875 0 -0.7550851096 3.5559775361 0.3812251473 0 1.4631675527 -1.55101932 3.679342877 0 1.4218035372 -1.7059620685 2.7084853018 0 2.4001214428 -1.6069621289 3.9038750892 0 1.5901869182 -1.6482301911 -3.3617392085 0 0.7827426471 -1.4184362068 -2.8455065383 0 1.9902328985 -2.3920948957 -2.8948094613 0 1.3183319456 2.5267844417 -1.7954393372 0 0.4133407456 2.3176279909 -2.1217293183 0 0.2332641701 0.9190298157 0.7546715377 0 1.3766351613 2.0646171111 -0.9478252319 Gaussian 16 6-Nov-2024 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 138 C1[X(BF3H29O15)] RB3LYP 6-311+G(3df,2p) SP #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=Water) geom=check guess=read 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-1.7709,.8936,.946;-1.8123,1.1958,2.3426;-2.8226,-.0136,.6581;-2.0629,2.133,.2558;-.5213,.3363,.533;2.5299,1.2616,-2.4959;.9141,.1551,3.7962;-2.981,-2.0403,-1.3311;-3.0455,-1.3813,-.6217;1.6327,1.9901,1.3909;1.3651,1.7423,2.3052;-2.7287,-2.8748,-.8776;1.1619,2.8226,1.1863;3.1616,.5232,-2.6003;2.6188,-.2281,-2.9235;.6267,1.0953,3.8051;-.2689,1.0845,3.4304;1.1977,-1.8181,.9353;.4406,-1.2023,.8562;1.9538,-1.2802,.5987;-1.2904,1.9027,-2.5305;-1.6786,2.0824,-1.6593;-1.1455,.9329,-2.5164;3.1568,-.0491,.1481;3.1945,.1209,-.8185;2.6894,.7225,.5212;.4967,-3.851,-.7707;.7795,-3.1161,-.1774;.3487,-3.4271,-1.6256;-.621,-.76,-2.0315;-.4572,-.4093,-1.1297;-1.4267,-1.3118,-1.9185;-2.1179,-4.3573,-.0739;-1.1648,-4.2463,-.2976;-2.3989,-5.1489,-.549;.0377,4.1165,.3722;.44,3.9297,-.4921;-.7551,3.556,.3812;1.4632,-1.551,3.6793;1.4218,-1.706,2.7085;2.4001,-1.607,3.9039;1.5902,-1.6482,-3.3617;.7827,-1.4184,-2.8455;1.9902,-2.3921,-2.8948;1.3183,2.5268,-1.7954;.4133,2.3176,-2.1217;.2333,.919,.7547;1.3766,2.0646,-.9478; oldchk=/home/lamsabhi/diver/BF3-H2O/14H2OBF3OH/water/CONF223/opt-b3lyp.chk #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3bj scrf=(smd,Solvent=W 1/29=2,38=1,172=1/1 2/12=2,40=1/2 3/5=4,6=6,7=216,11=2,14=-4,25=1,30=1,70=32201,72=1,74=-5,116=-2,124=41/1,2,3 4/5=1/1 5/5=2,38=6,53=1/2 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,9=1/99 Single Point 14H2OBF3OH CONF223 water Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 11 19 19 19 16 1 1 16 1 16 1 1 1 16 1 16 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 16 1 1 1 11.0093053 18.9984033 18.9984033 18.9984033 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 15.9949146 1.0078250 1.0078250 1.0078250 3 1 1 1 0 1 1 0 1 0 1 1 1 0 1 0 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 0 1 1 1 2.7500000 6.7500000 6.7500000 6.7500000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 5.6000000 1.0000000 1.0000000 1.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) 6-311+G(3df,2p) (5D, 7F) 0.10000e-02 0.10000e-05 F 1116 A 1002 A 1002 1421 1116 91 91 2087.3848596532 48 48 48 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=141 Grimme-D3(BJ) -0.0589086310 PCM SMD-Coulomb. Total charges None On-the-fly selection Water 78.355300 1.777849 0.000000 1.429564 0.000000 1.418481 2.306729 0.000000 1.448307 2.301244 2.312318 0.000000 1.429197 2.383341 2.331118 2.383573 0.000000 5.520793 6.501634 6.342232 5.424535 4.397805 0.000000 3.984773 3.260297 4.882564 5.030790 3.569580 6.589872 0.000000 3.906074 5.033336 2.844212 4.558264 3.895258 6.529155 6.802997 0.000000 3.042621 4.116965 1.886320 3.753130 3.264165 6.448481 6.128335 0.970396 0.000000 3.603448 3.661322 4.939846 3.868640 2.847990 4.054987 3.109571 6.703725 6.107579 0.000000 3.521692 3.224324 4.830470 4.012968 2.945565 4.963776 2.223884 6.813198 6.146305 0.984428 0.000000 4.294644 5.270630 3.248670 5.177473 4.144068 6.883449 6.655398 0.982740 1.548031 6.916301 6.943130 0.000000 3.518521 3.581841 4.919305 3.426485 3.072751 4.226956 3.740103 6.866508 6.216419 0.978002 1.568511 7.201164 0.000000 6.086233 7.044453 6.834907 6.167957 4.839005 0.977250 6.789814 6.775998 6.787469 4.518637 5.364434 7.014959 4.860422 0.000000 5.958204 7.028103 6.517880 6.131965 4.703822 1.552387 6.943121 6.097338 6.221896 4.950382 5.726560 6.307620 5.321612 0.981655 0.000000 3.736774 2.845655 4.799072 4.572482 3.549735 6.584262 0.983250 7.016263 6.262173 2.764243 1.792562 6.996276 3.182373 6.912385 7.140948 0.000000 2.909438 1.891518 3.925950 3.794167 3.003123 6.556440 1.548281 6.308081 5.496281 2.931950 2.090192 6.347087 3.178721 6.960801 7.101694 0.970888 0.000000 4.020778 4.486114 4.415534 5.167685 2.785432 4.799240 3.486949 4.759003 4.540936 3.859965 3.818538 4.451971 4.647614 4.673201 4.408804 4.129163 4.099043 0.000000 3.048222 3.610573 3.478644 4.213329 1.843102 4.655423 3.272686 4.146531 3.790609 3.449443 3.409571 3.980874 4.102320 4.725301 4.469842 3.742963 3.515637 0.979189 0.000000 4.326590 4.832780 4.941894 5.282148 2.956943 4.045859 3.655834 5.352984 5.147082 3.380116 3.520509 5.162172 4.219558 3.865764 3.735570 4.205370 4.307095 0.987092 1.536966 0.000000 3.651707 4.951712 4.023279 2.900605 3.525636 3.873940 6.923982 4.454615 4.184290 4.891821 5.519259 5.255952 4.547019 4.661351 4.469533 6.668341 6.102938 5.661037 4.909898 5.517914 0.000000 2.865144 4.101116 3.327457 1.953954 3.032213 4.368728 6.340294 4.335936 3.865491 4.503033 5.009757 5.127128 4.088325 5.171475 5.040288 6.012325 5.374794 5.497237 4.648440 5.440573 0.970584 0.000000 3.518616 4.911601 3.712944 3.157083 3.169260 3.690141 6.685493 3.689708 3.543361 4.909473 5.496029 4.437434 4.754500 4.327320 3.960229 6.567178 6.012995 4.997308 4.295229 4.920048 0.980650 1.529774 0.000000 5.080115 5.572997 6.001276 5.658468 3.718248 3.016868 4.287241 6.620126 6.390300 2.832922 3.327517 6.608782 3.647417 2.807280 3.123441 4.591812 4.877976 2.754506 3.034707 1.779296 5.546358 5.584911 5.154935 0.000000 5.325888 6.017983 6.197084 5.730823 3.959787 2.134599 5.147502 6.562782 6.421231 3.288477 3.966482 6.637877 3.930567 1.826911 2.210004 5.377752 5.565701 3.289757 3.484162 2.347462 5.120538 5.319905 4.730457 0.982118 0.000000 4.483705 4.879238 5.562623 4.964272 3.233858 3.069092 3.768168 6.573985 6.214550 1.865377 2.444657 6.652244 2.680638 3.163275 3.574144 3.895800 4.164874 2.975061 2.978940 2.134836 5.152174 5.067900 4.896685 0.976206 1.553007 0.000000 5.531780 6.363573 5.271189 6.588906 4.502157 5.766195 6.089308 3.960713 4.320720 6.330993 6.442081 3.371561 6.986348 5.439018 4.718360 6.739509 6.526488 2.744912 3.108936 3.256944 6.276581 6.381752 5.350682 4.730252 4.801700 5.233883 0.000000 4.883056 5.626777 4.826921 5.984956 3.757065 5.253880 5.148576 4.078006 4.223447 5.409262 5.487228 3.585536 6.105169 4.978849 4.389073 5.798200 5.635629 1.759994 2.201260 2.313378 5.916887 5.938218 5.056738 3.894086 4.089108 4.343930 0.985997 0.000000 5.456542 6.464332 5.188873 6.345849 4.424818 5.243930 6.522784 3.618972 4.088196 6.331910 6.573140 3.214768 6.901146 4.946447 4.131727 7.072544 6.804304 3.141248 3.334199 3.483205 5.649056 5.870718 4.694195 4.737318 4.619282 5.225504 0.965579 1.542556 0.000000 3.594745 4.937364 3.555033 3.959879 2.790774 3.772414 6.095579 2.774756 2.872558 4.935099 5.386419 3.200945 5.135014 4.034642 3.402183 6.250168 5.775721 3.637212 3.108255 3.717258 2.790551 3.055570 1.837451 4.419045 4.099414 4.435403 3.520351 3.309081 2.866735 0.000000 2.780637 4.058310 2.991360 3.310825 1.823319 3.685293 5.144233 3.011722 2.811082 4.059320 4.443951 3.361831 4.293082 4.015924 3.565390 5.271657 4.802242 2.997914 2.319123 3.091640 2.828806 2.825111 2.049002 3.850092 3.703006 3.729217 3.589386 3.124501 3.162585 0.981391 0.000000 3.631479 4.959244 3.205130 4.122997 3.089616 4.755069 6.347373 1.814295 2.075331 5.587012 5.912842 2.285111 5.782217 4.988447 4.307013 6.539887 5.974438 3.910055 3.346302 4.214884 3.275022 3.413356 2.339891 5.184019 4.961641 5.199295 3.385947 3.339835 2.777123 0.983028 1.541663 0.000000 5.360303 6.063823 4.461001 6.498920 4.994703 7.683795 6.673198 2.773866 3.164994 7.516781 7.415938 1.793574 7.993480 7.620720 6.899758 7.232556 6.731395 4.296415 4.167078 5.147794 6.775491 6.646523 5.907444 6.814158 6.987838 7.019102 2.752814 3.153798 3.058951 4.360437 4.411259 3.627099 0.000000 5.322842 6.083305 4.645182 6.465939 4.701486 6.987187 6.360249 3.038639 3.442407 7.040572 7.002719 2.159423 7.588442 6.838763 6.112021 6.969510 6.566420 3.605224 3.629624 4.396252 6.543063 6.493888 5.634504 6.040856 6.192504 6.341426 1.772212 2.252193 2.173800 3.931444 3.989410 3.362668 0.985249 0.000000 6.256352 6.997234 5.292314 7.333990 5.897760 8.317394 7.615029 3.257973 3.823408 8.425127 8.354817 2.321302 8.901436 8.203695 7.418226 8.191615 7.695963 5.121831 5.060905 5.935535 7.408141 7.351446 6.513882 7.573683 7.689579 7.842773 3.180924 3.791189 3.416614 4.961989 5.154745 4.188644 0.965080 1.549492 0.000000 3.739926 3.979402 5.031966 2.891397 3.824700 4.752648 5.308966 7.065389 6.381187 2.846672 3.337031 7.621881 1.897654 5.612961 6.033145 4.610766 4.317423 6.073110 5.355968 5.731199 3.884647 3.348166 4.458581 5.208729 5.229477 4.309647 8.062126 7.291232 7.809790 5.476497 4.794118 6.071065 8.755042 8.475308 9.624641 0.000000 4.021697 4.536843 5.245714 3.170518 3.858472 3.937268 5.732565 6.931718 6.353954 2.954706 3.669573 7.516061 2.136374 4.843075 5.286429 5.151128 4.897367 5.970721 5.306204 5.533915 3.355401 3.043658 3.948762 4.860185 4.711738 4.046345 7.785929 7.060976 7.444161 5.048717 4.476498 5.743943 8.682908 8.334316 9.512364 0.971425 0.000000 2.904960 3.245778 4.134367 1.936712 3.231726 4.932921 5.100433 6.261388 5.534298 3.028719 3.389192 6.843586 2.204798 5.781619 6.051737 4.436970 3.955024 5.744706 4.929156 5.547398 3.390914 2.681072 3.928001 5.324811 5.370098 4.462371 7.599822 6.868996 7.349038 4.946434 4.253861 5.425397 8.042655 7.842453 8.907461 0.970973 1.526668 0.000000 4.889465 4.478958 5.464442 6.142117 4.171307 6.868972 1.796069 6.715280 6.233445 4.219631 3.569807 6.331658 5.043208 6.827924 6.832473 2.778250 3.163556 2.769772 3.022845 3.131236 7.620550 7.181488 7.166741 4.194547 5.101301 4.079946 5.101686 4.217961 5.736159 6.130517 5.302618 6.304358 5.897940 5.476015 6.763076 6.714921 6.963207 6.471448 0.000000 4.478585 4.360506 5.008376 5.735530 3.560816 6.092641 2.214570 5.984572 5.581424 3.929551 3.472190 5.608285 4.784549 6.014893 5.944388 3.111579 3.341625 1.790814 2.155815 2.217127 6.915614 6.560635 6.391713 3.508751 4.349639 3.505429 4.190705 3.275551 4.785148 5.247416 4.465782 5.447824 5.224984 4.709600 6.087928 6.424576 6.555041 6.151666 0.984014 0.000000 5.692065 5.295103 6.352286 6.871250 4.865601 7.014481 2.307520 7.519954 7.084243 4.454527 3.852819 7.125638 5.342162 6.886312 6.968621 3.233763 3.819946 3.209799 3.645830 3.351176 8.206049 7.822823 7.761582 4.135907 5.090904 4.117299 5.523655 4.643331 6.172171 6.713662 5.910582 6.973687 6.618092 6.109591 7.443388 7.128255 7.336304 7.001452 0.965105 1.547858 0.000000 6.026127 7.225334 6.189028 6.381965 4.854439 3.178017 7.412498 5.017279 5.391513 5.985520 6.607624 5.131085 6.391893 2.786483 1.807439 7.734238 7.553652 4.318254 4.394457 3.994062 4.647339 5.244139 3.854952 4.162985 3.488784 4.680360 3.572290 3.598842 2.778465 2.729059 3.272389 3.361209 5.647926 4.871250 6.006623 7.041604 6.377412 6.825970 7.042899 6.072834 7.310735 0.000000 5.122689 6.362812 5.219915 5.507144 4.024149 3.218297 6.826818 4.104387 4.427407 5.503400 6.071188 4.280624 5.863920 3.080458 2.189529 7.111496 6.837985 3.824447 3.723738 3.640448 3.927724 4.440860 3.058612 4.058685 3.506383 4.421938 3.209967 3.162386 2.389823 1.751167 2.345138 2.398405 4.973192 4.275712 5.414206 6.445453 5.853113 6.125480 6.561571 5.598026 6.943026 0.985529 0.000000 6.300286 7.400225 6.437714 6.843306 5.049920 3.714804 7.239873 5.223247 5.616681 6.139898 6.672642 5.154638 6.673408 3.155638 2.253597 7.675260 7.563012 3.953113 4.229291 3.666349 5.416684 5.916762 4.586004 4.013709 3.475113 4.675308 2.978387 3.061735 2.318791 3.198040 3.610636 3.714261 5.356910 4.487541 5.689263 7.539703 6.938418 7.324530 6.648660 5.673694 6.856133 0.965088 1.551926 0.000000 4.441360 5.356861 5.442488 3.974330 3.688373 1.886646 6.087279 6.289522 5.974411 3.246455 4.175305 6.811599 3.000488 2.838933 3.248566 5.821769 5.648836 5.133201 4.659159 4.541853 2.781269 3.032786 3.021684 3.713787 3.203517 3.240726 6.511627 5.894911 6.034678 3.823599 3.495197 4.720689 7.884294 7.367782 8.619061 2.977519 2.106744 3.177446 6.828082 6.181601 7.123224 4.467432 4.117555 5.084824 0.000000 4.026076 5.112960 4.861404 3.437803 3.441908 2.394844 6.320551 5.580152 5.281621 3.732638 4.564529 6.195278 3.429091 3.316886 3.462323 6.055273 5.728227 5.202422 4.610715 4.766309 1.800584 2.155344 2.122057 4.275494 3.776059 3.835377 6.315389 5.782680 5.766441 3.248077 3.029566 4.074260 7.426680 6.993080 8.132150 3.097816 2.292450 3.027129 7.051312 6.366887 7.460403 4.318637 3.823413 5.026503 0.984490 0.000000 2.013418 2.604355 3.196502 2.644783 0.978846 3.994812 3.209061 4.841454 4.235104 1.873621 2.088793 5.082386 2.161525 4.470717 4.531608 3.080701 2.727501 2.907737 2.133873 2.796614 3.752562 3.291815 3.549796 3.138840 3.446816 2.474997 5.014924 4.177208 4.956544 3.363305 2.406661 3.857205 5.835584 5.453662 6.741511 3.226197 3.265195 2.840738 4.020884 3.481465 4.581854 5.037549 4.327465 5.231558 3.203953 3.203465 0.000000 3.855449 4.663828 4.952941 3.644679 2.963465 2.090843 5.134801 5.998854 5.615672 2.353857 3.269011 6.423117 2.274908 2.879662 3.271513 4.908343 4.778879 4.319015 3.847536 3.729923 3.105538 3.137062 3.178402 2.972819 2.664436 2.383862 5.983329 5.271569 5.628012 3.625406 3.084851 4.494554 7.363189 6.834428 8.151633 2.783031 2.136246 2.921432 5.872904 5.252420 6.169847 4.433714 4.010681 4.901993 0.967185 1.539481 2.349077 0.000000 BF3H29O15(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 307.7972096 AuxInfo=1/0/N:1;2;3;4;5;8;10;14;16;18;21;24;27;30;33;36;39;42;45;6;7;9;11;12;13;15;17;19;20;22;23;25;26;28;29;31;32;34;35;37;38;40;41;43;44;46;47;48/rA:48nB0F0F0F0O0H0H0O0H0O0H0H0H0O0H0O0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0O0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:-.8654,-1.4601,-1.4103;-1.614,-2.5947,-.9676;.2491,-1.9276,-2.1529;-1.7272,-.7394,-2.3245;-.4198,-.6318,-.3343;-.7576,3.6132,.7642;-1.6067,-2.7412,2.2894;2.8283,-.7742,-2.4795;1.9879,-1.2583,-2.4473;-2.605,.0529,1.359;-2.6424,-.9058,1.5792;3.403,-1.2231,-1.8207;-3.2258,.1851,.6149;-.1456,3.8413,1.4912;.751,3.6845,1.1236;-2.4309,-2.677,1.757;-2.1421,-2.7949,.8376;1.1457,-.6244,1.9696;.7308,-.7853,1.0973;.6354,.1463,2.3161;-.6945,1.9407,-2.7295;-1.0923,1.0559,-2.762;.1731,1.7816,-2.3011;-.5524,1.3845,2.787;-.3865,2.2589,2.3718;-1.3144,1.0156,2.3009;3.7256,.0258,1.2943;2.7959,-.1752,1.5541;3.6499,.7729,.6873;1.4851,1.2453,-1.1318;.8257,.6397,-.73;2.0927,.637,-1.6082;4.3971,-1.9404,-.5115;4.21,-1.2658,.1818;5.3386,-1.8512,-.7039;-3.9554,.6209,-1.0818;-3.5559,1.505,-1.0321;-3.3064,.1048,-1.5869;-.0816,-2.7591,3.2378;.3997,-1.992,2.8528;-.2643,-2.5091,4.1519;2.3872,3.2406,.4971;2.1349,2.465,-.0562;2.8486,2.872,1.2604;-1.9622,2.7184,-.3793;-1.5049,2.5106,-1.226;-1.1616,-.3244,.2256;-1.8335,1.9255,.1595; 0.2125080 0.1874234 0.1734444 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 1002 RedAO= T EigKep= 2.61D-05 NBF= 1002 NBsUse= 1002 1.00D-06 EigRej= -1.00D+00 NBFU= 1002 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 1088 1081 1081 1088 1088 MxSgAt= 48 MxSgA2= 48. 1 Closed 1 1 1 -1471.50457366114 -1471.55585151340 -0.051277852255 -1471.55608419377 -0.000232680369 -1471.55624546701 -0.000161273239 -1471.55626043153 -0.000014964522 -1471.55626157509 -0.000001143564 -1471.55626160887 -0.000000033776 -1471.55626162053 -0.000000011663 -1471.55626162063 -0.000000000098 -1471.55626162 9 1.466470200856e+03 -7.678009925906e+03 2.652643794690e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 11324620800 LenX= 11322110188 LenY= 11320863616 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. PT5674.600S Wed Nov 6 05:22:53 2024 -24.64398 -24.64294 -24.64011 -19.12442 -19.12321 -19.12172 -19.12123 -19.12097 -19.12074 -19.12025 -19.11909 -19.11891 -19.11856 -19.11529 -19.11486 -19.11237 -19.11029 -19.10888 -6.84378 -1.19341 -1.15236 -1.14920 -1.02495 -1.01987 -1.01849 -1.01393 -1.01182 -1.01037 -1.00815 -1.00652 -1.00402 -0.99897 -0.99690 -0.99336 -0.99243 -0.98965 -0.98513 -0.57333 -0.53776 -0.53659 -0.53287 -0.53095 -0.53055 -0.52931 -0.52871 -0.52750 -0.52692 -0.52583 -0.52365 -0.52227 -0.51730 -0.51403 -0.50932 -0.49474 -0.48980 -0.44060 -0.42781 -0.42493 -0.42425 -0.41875 -0.41607 -0.41397 -0.41147 -0.40783 -0.40742 -0.40006 -0.39920 -0.39493 -0.39190 -0.38868 -0.38268 -0.37996 -0.37693 -0.37349 -0.36977 -0.35393 -0.32865 -0.32459 -0.32412 -0.32303 -0.32237 -0.32129 -0.32057 -0.31930 -0.31833 -0.31767 -0.31553 -0.31512 -0.31289 -0.31133 -0.30997 -0.00619 0.01731 0.02327 0.02458 0.04698 0.05119 0.05702 0.06827 0.07566 0.08084 0.08984 0.09238 0.09947 0.10773 0.11119 0.11536 0.11559 0.12178 0.13424 0.13537 0.13808 0.14125 0.14524 0.14774 0.14927 0.15420 0.15579 0.16174 0.16592 0.16872 0.17035 0.17396 0.17944 0.18166 0.18480 0.18836 0.19070 0.19327 0.19538 0.20085 0.20249 0.20473 0.21167 0.21359 0.21850 0.22602 0.22674 0.22855 0.23117 0.23608 0.23828 0.24167 0.24299 0.24609 0.24913 0.25035 0.25304 0.25712 0.26220 0.26549 0.26777 0.26853 0.27172 0.27285 0.27491 0.27659 0.28106 0.28410 0.28662 0.28878 0.29062 0.29519 0.29869 0.29994 0.30628 0.31079 0.31478 0.31908 0.32435 0.32905 0.33295 0.33506 0.34627 0.34774 0.35881 0.36388 0.36689 0.37781 0.38481 0.39013 0.40062 0.40597 0.41255 0.42571 0.42891 0.43841 0.44440 0.45488 0.45638 0.46059 0.47156 0.48051 0.48451 0.48775 0.49564 0.49646 0.50742 0.50793 0.51255 0.51571 0.52231 0.52655 0.53210 0.53494 0.54075 0.54843 0.54974 0.55221 0.55496 0.55873 0.57073 0.57272 0.57587 0.58142 0.58397 0.58800 0.59223 0.59930 0.60359 0.60613 0.61202 0.61380 0.62208 0.62308 0.62818 0.63024 0.63863 0.64594 0.64690 0.64985 0.65495 0.66277 0.66575 0.67083 0.67904 0.68300 0.68585 0.68871 0.69873 0.70374 0.70740 0.71762 0.71998 0.72384 0.72632 0.73628 0.74387 0.74999 0.75611 0.76522 0.77012 0.77239 0.77722 0.78603 0.79414 0.80096 0.80248 0.81431 0.81605 0.82137 0.82786 0.83668 0.84384 0.84692 0.85025 0.85291 0.85727 0.86364 0.86842 0.87178 0.87894 0.87958 0.88108 0.88741 0.89746 0.89989 0.90491 0.91437 0.91698 0.92041 0.92230 0.92953 0.93185 0.93724 0.94879 0.95045 0.95673 0.96627 0.96788 0.96854 0.97437 0.97657 0.98352 0.98547 0.99157 0.99272 0.99321 0.99929 1.00660 1.01320 1.01775 1.02097 1.02174 1.02558 1.02946 1.03332 1.03681 1.04536 1.04635 1.04917 1.04966 1.05703 1.05936 1.06275 1.06529 1.07015 1.07122 1.07592 1.08046 1.08526 1.08944 1.09220 1.10145 1.10503 1.10609 1.11377 1.11503 1.12209 1.13148 1.13369 1.13847 1.14286 1.14628 1.14832 1.15317 1.15904 1.16249 1.17202 1.17522 1.18191 1.18518 1.19318 1.19859 1.20051 1.20333 1.21260 1.21650 1.22250 1.22550 1.23507 1.23717 1.24729 1.25505 1.25528 1.25864 1.26441 1.26721 1.27090 1.27888 1.28232 1.29251 1.29794 1.30549 1.30963 1.31120 1.32267 1.32327 1.32394 1.32982 1.33504 1.34438 1.35193 1.35382 1.36308 1.36829 1.37600 1.37712 1.38428 1.38928 1.39560 1.40230 1.40343 1.40960 1.41146 1.41842 1.42132 1.42749 1.43423 1.44154 1.44704 1.45563 1.46478 1.47577 1.47727 1.48201 1.48561 1.49663 1.50091 1.50403 1.50567 1.51578 1.52353 1.53448 1.53831 1.54189 1.54578 1.55309 1.55859 1.56683 1.57869 1.58952 1.59052 1.59602 1.60588 1.60747 1.61713 1.62348 1.63302 1.63538 1.64673 1.65184 1.65336 1.65987 1.66915 1.67780 1.68768 1.69859 1.70203 1.71995 1.72706 1.73203 1.74159 1.75437 1.75930 1.76661 1.78042 1.79064 1.80319 1.81672 1.82364 1.83966 1.85052 1.86080 1.86698 1.87583 1.90076 1.91818 1.92188 1.92589 1.93331 1.95105 1.95862 1.96450 1.97310 1.98598 1.99472 2.00684 2.01720 2.05476 2.06110 2.08625 2.09290 2.10800 2.13089 2.15200 2.15917 2.16782 2.19028 2.19913 2.21771 2.22090 2.23042 2.23911 2.24435 2.25453 2.26236 2.27367 2.28017 2.28659 2.29369 2.29794 2.30826 2.32866 2.33603 2.34518 2.35143 2.36927 2.40529 2.42507 2.43440 2.48804 2.56230 2.60433 2.63714 2.69896 2.70745 2.72137 2.72566 2.73524 2.74507 2.74744 2.74950 2.77192 2.78023 2.79241 2.79614 2.80844 2.80968 2.81724 2.82347 2.84093 2.84648 2.86455 2.86731 2.87118 2.88487 2.89018 2.90853 2.92382 2.96169 2.97776 2.98466 3.00848 3.01620 3.04715 3.08495 3.11847 3.13539 3.14605 3.14867 3.16438 3.16700 3.18057 3.18111 3.19521 3.19728 3.20230 3.21150 3.21675 3.23178 3.24546 3.25581 3.26322 3.27113 3.28049 3.28634 3.29573 3.30000 3.30241 3.31229 3.32185 3.32707 3.34054 3.34708 3.35296 3.36247 3.36742 3.38736 3.39002 3.39970 3.40350 3.41045 3.41806 3.42618 3.43240 3.43588 3.44731 3.45177 3.45221 3.46002 3.47197 3.47546 3.47831 3.48677 3.49296 3.49882 3.50349 3.51165 3.51539 3.52319 3.53040 3.54368 3.54911 3.55723 3.56140 3.56991 3.57544 3.57948 3.58909 3.60936 3.61614 3.62216 3.62693 3.63710 3.64950 3.66400 3.67838 3.68668 3.70438 3.73915 3.74202 3.75473 3.78065 3.82789 3.84325 3.85339 3.86239 3.87277 3.89784 3.91633 3.92607 3.92962 3.94054 3.95903 3.96755 3.99011 4.02252 4.03204 4.03700 4.05149 4.05782 4.08353 4.10885 4.12533 4.12710 4.13322 4.14031 4.14178 4.15785 4.16304 4.16598 4.17271 4.17618 4.18375 4.19372 4.20249 4.20966 4.21807 4.22512 4.22854 4.24109 4.26116 4.27046 4.29463 4.30194 4.31129 4.31764 4.32735 4.33730 4.34118 4.35250 4.35929 4.37126 4.38572 4.39432 4.40506 4.41704 4.42544 4.43743 4.44817 4.46228 4.47746 4.50877 4.64814 4.65711 4.66622 4.67705 4.70206 4.71007 4.71331 4.72593 4.73447 4.73960 4.74909 4.75122 4.75569 4.76897 4.77303 4.77727 4.78285 4.79249 4.80416 4.80602 4.81943 4.82388 4.84418 4.85703 4.86098 4.87802 4.88329 4.89974 4.90043 4.90787 4.90947 4.92284 4.93182 4.93576 4.94874 4.95435 4.96390 4.96712 4.97634 4.99832 5.01835 5.02084 5.02423 5.03221 5.03644 5.03736 5.04115 5.04299 5.04842 5.04943 5.05694 5.06236 5.07482 5.09249 5.10147 5.10905 5.12597 5.14139 5.14575 5.15922 5.16229 5.16726 5.18347 5.18729 5.20029 5.21312 5.21637 5.22529 5.23546 5.24221 5.25215 5.25357 5.26898 5.27502 5.28382 5.28909 5.29221 5.29942 5.30054 5.31112 5.31458 5.31762 5.32117 5.32826 5.33105 5.33456 5.33974 5.34388 5.35048 5.36326 5.36463 5.36996 5.37254 5.38038 5.38347 5.39293 5.40115 5.40552 5.41085 5.41950 5.42501 5.43042 5.43753 5.44075 5.44478 5.45412 5.45591 5.45964 5.46257 5.47133 5.47459 5.47647 5.49024 5.49493 5.50057 5.50599 5.51661 5.53564 5.56236 5.57367 5.58470 5.58684 5.59141 5.59268 5.59742 5.60178 5.60891 5.61105 5.61549 5.61931 5.62267 5.62756 5.63108 5.63619 5.64691 5.65515 5.66384 5.67219 5.67659 5.68718 5.68764 5.69610 5.69897 5.71758 5.71929 5.72187 5.73032 5.73320 5.75224 5.76307 5.77267 5.80090 5.82260 5.82800 5.83792 5.84873 5.86350 5.86676 5.87411 5.89779 5.92437 5.92665 5.93883 5.94893 5.96207 5.98165 5.99661 6.03676 6.04842 6.16682 6.46589 6.48092 6.53377 6.59337 6.60080 6.62041 6.65514 6.66339 6.66965 6.68751 6.72090 6.72843 6.76234 6.77257 6.78179 6.86860 6.87178 6.90597 6.94339 6.95329 6.95722 6.96175 6.97920 6.98492 6.99338 6.99458 7.00060 7.00955 7.01015 7.01803 7.02761 7.03208 7.03681 7.04416 7.05304 7.05659 7.06388 7.06737 7.08419 7.09000 7.09536 7.10155 7.11432 7.11794 7.12037 7.14158 7.15325 7.16123 7.17557 7.19028 7.26724 7.30865 7.38765 7.41792 7.45387 7.47349 7.67829 8.06818 8.07577 14.36492 14.37119 14.37479 14.37769 14.37953 14.38343 14.38452 14.38903 14.39032 14.39059 14.39189 14.39521 14.39616 14.39840 14.39938 14.40188 14.40574 14.40707 14.41136 14.41271 14.41605 14.42551 14.42818 14.43119 14.43345 14.44203 14.44499 14.45017 14.45255 14.45340 14.45942 14.46629 14.47435 14.47552 14.47904 14.48802 14.49549 14.50032 14.50930 14.51271 14.53457 14.54898 14.58443 14.60856 14.64256 14.67384 14.67628 14.68655 14.69058 14.69450 14.70557 14.70873 14.71019 14.71454 14.71714 14.73988 14.74643 14.76077 14.77103 14.78593 15.04283 15.06684 15.06925 15.07280 15.07846 15.08147 15.08214 15.08522 15.08853 15.09115 15.09380 15.09708 15.09883 15.10181 15.11966 16.06674 19.35755 19.38060 19.38760 19.39903 19.40297 19.40748 19.42266 19.42972 19.50200 19.52709 19.53774 19.58101 19.60260 19.63412 19.67415 50.01536 50.02600 50.03787 50.04410 50.04902 50.05393 50.05660 50.05855 50.06447 50.07233 50.07944 50.11365 50.12145 50.13091 50.24464 67.01658 67.08149 67.08918 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 B F F F O H H O H O H H H O H O H O H H O H H O H H O H H O H H O H H O H H O H H O H H O H H H 1.496537 -0.547450 -0.562528 -0.514505 -1.291634 0.399630 0.466883 -0.863730 0.399668 -0.857915 0.437822 0.463278 0.381742 -0.870339 0.455314 -0.824650 0.346746 -0.936855 0.520196 0.450270 -0.761901 0.315066 0.417101 -0.885767 0.468368 0.396556 -0.759441 0.471970 0.292185 -0.910465 0.524291 0.423909 -0.815283 0.495298 0.298383 -0.707631 0.341058 0.347731 -0.793622 0.481861 0.288849 -0.790606 0.486315 0.284889 -0.817435 0.444562 0.521239 0.394042 -1.00000 5.1328 0.4563 2.7254 5.8294 -154.5327 -191.1833 -161.9831 -0.3282 1.6125 -4.8471 14.7003 -21.9502 7.2499 -0.3282 1.6125 -4.8471 169.9134 -77.8690 65.0472 17.2522 13.4882 -10.1809 -5.4829 -33.7610 -34.7161 6.8110 -3837.0186 -4001.1572 -2648.1796 -99.0390 -142.1489 -55.5610 -19.1617 69.9714 -116.1473 -1340.5843 -1266.9947 -1140.1490 102.5271 52.3366 58.1252 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) GINC-GARGANTA LAMSABHI 06-Nov-2024 0 Single Point 14H2OBF3OH CONF223 water -1 1 Version=EM64L-G16RevC.01 State=1-A HF=-1471.5562616 RMSD=4.675e-09 Dipole=0.6675097,-2.1570708,-0.4018103 Quadrupole=-2.8169665,10.3183284,-7.501362,-2.4151581,10.6756962,4.0936142 PG=C01 [X(B1F3H29O15)] 0 -1.7708861513 0.8936443498 0.9459588508 0 -1.8123451151 1.1958349741 2.3426028916 0 -2.8226451168 -0.0135527588 0.6580628394 0 -2.0628756158 2.1330188476 0.2558244551 0 -0.5213250062 0.3362909996 0.5329712914 0 2.5299470001 1.2615843294 -2.4959322225 0 0.9140752783 0.1550594042 3.7962034082 0 -2.9810259215 -2.0402736531 -1.3311224956 0 -3.0454825846 -1.3812938235 -0.6217153668 0 1.6327458308 1.9900851199 1.3908701812 0 1.3651194081 1.7422660598 2.3052331736 0 -2.7286875767 -2.8747991695 -0.8776129318 0 1.1619482407 2.822553489 1.1863373112 0 3.1615995194 0.5232416829 -2.6002523678 0 2.6188008522 -0.228121224 -2.9234706327 0 0.6266868032 1.0953311369 3.8050573653 0 -0.2689462601 1.084490042 3.4304274928 0 1.1977481305 -1.8181366365 0.9352877115 0 0.4405659301 -1.2023224043 0.8561733925 0 1.9538061511 -1.280162675 0.5986695795 0 -1.2904208046 1.9026782264 -2.5305291992 0 -1.6786290169 2.0823949366 -1.6593066885 0 -1.1454700591 0.9329031082 -2.516406414 0 3.1568166218 -0.0490573145 0.1480697455 0 3.194459269 0.1209063478 -0.8184971443 0 2.6893727666 0.7224528861 0.5212261898 0 0.4966853417 -3.8510025392 -0.7707343796 0 0.7795272315 -3.1160537835 -0.1774038049 0 0.3487011731 -3.4270628332 -1.6255551515 0 -0.6210016981 -0.7600329559 -2.0315083676 0 -0.4571511068 -0.4093395368 -1.1296796481 0 -1.426713566 -1.3117669616 -1.9185385654 0 -2.1178905448 -4.3573000875 -0.073856725 0 -1.1648218214 -4.2462923539 -0.2975795867 0 -2.398910018 -5.1489318938 -0.5489634817 0 0.0377115954 4.1164953483 0.3721519557 0 0.440049208 3.929732574 -0.4920877875 0 -0.7550851096 3.5559775361 0.3812251473 0 1.4631675527 -1.55101932 3.679342877 0 1.4218035372 -1.7059620685 2.7084853018 0 2.4001214428 -1.6069621289 3.9038750892 0 1.5901869182 -1.6482301911 -3.3617392085 0 0.7827426471 -1.4184362068 -2.8455065383 0 1.9902328985 -2.3920948957 -2.8948094613 0 1.3183319456 2.5267844417 -1.7954393372 0 0.4133407456 2.3176279909 -2.1217293183 0 0.2332641701 0.9190298157 0.7546715377 0 1.3766351613 2.0646171111 -0.9478252319