Gaussian 16 GINC-BELVIS8 APULGAR Optimization famoxadone CONF42 gas EM64L-G16RevC.01 3-May-2022 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 46 46 98 98 724 (5D, 7F) 6-311+G(d,p) 132 132 C1[X(C22H18N2O4)] C1[X(C22H18N2O4)] RB3LYP 6-311+G(d,p) FOpt #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 opt freq 356.2463999999997 0 1 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:1.9277,-2.1366,1.2001;2.741,-1.2411,-2.0687;3.1303,-.6932,2.4296;-3.7231,-.7023,-1.2625;3.11,-.618,.1235;3.9093,.4617,-.0705;1.5989,-2.3098,-.1818;.1705,-1.8624,-.4295;2.5475,-1.3516,-.8958;1.8409,-3.7561,-.5731;2.7489,-1.0985,1.3811;-.3318,-1.8418,-1.73;-.6642,-1.4712,.609;-1.6267,-1.4361,-1.984;-1.9699,-1.0687,.366;-2.4531,-1.0487,-.9346;3.338,1.7331,.0794;4.1823,2.8197,.2932;1.9687,1.945,-.0402;-4.4695,.0617,-.4073;3.6618,4.0978,.3902;1.4611,3.2311,.0611;2.2963,4.3152,.2759;-5.6878,-.4394,.0217;-4.0484,1.3282,-.0239;-6.4954,.3391,.8381;-4.8594,2.0915,.8001;-6.0831,1.6014,1.2349;1.1681,-4.409,-.0192;2.8692,-4.0555,-.3695;1.6518,-3.8926,-1.6357;.2974,-2.1201,-2.565;-.3161,-1.4841,1.6323;4.8228,.3459,.3407;-2.0056,-1.4146,-2.9972;-2.5988,-.781,1.198;5.2512,2.6662,.3845;1.286,1.1247,-.2193;4.3324,4.9297,.5598;.3935,3.3801,-.0338;1.8912,5.3145,.3534;-6.0001,-1.4268,-.2914;-3.0989,1.7155,-.3717;-7.4494,-.0495,1.1691;-4.5344,3.0792,1.0986;-6.7133,2.2037,1.8749; g16 /usr/local/gaussian/gaussian16/g16/l1.exe "/temporal/apulgar/opt-b3lyp-pople.com-3609666/Gau-20940.inp" -scrdir="/temporal/apulgar/opt-b3lyp-pople.com-3609666/" chk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/famoxadone/gas/CONF42/ #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 opt freq 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=1,71=1,74=-5,124=31/1,2,3 4//1 5/5=2,38=5/2 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=1,71=1,74=-5,124=31/1,2,3 4/5=5,16=3,69=1/1 5/5=2,38=5/2 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 famoxadone CONF42 gas 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 16 16 16 16 14 14 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.9949146 15.9949146 15.9949146 15.9949146 14.0030740 14.0030740 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 (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 1 1 2 3 4 4 5 5 5 6 6 7 7 7 8 8 10 10 10 12 12 13 13 14 14 15 15 17 17 18 18 19 19 20 20 21 21 22 22 23 24 24 25 25 26 26 27 27 28 7 11 9 11 16 20 6 9 11 17 34 8 9 10 12 13 29 30 31 14 32 15 33 16 35 16 36 18 19 21 37 22 38 24 25 23 39 23 40 41 26 42 27 43 28 44 28 45 46 1.431 1.3359 1.1939 1.187 1.3566 1.3682 1.3573 1.3761 1.3939 1.4019 1.0084 1.5171 1.5257 1.5178 1.3942 1.3887 1.0889 1.0902 1.0879 1.3806 1.082 1.3878 1.0809 1.3908 1.0819 1.3877 1.0819 1.3925 1.3908 1.3834 1.0838 1.3864 1.0821 1.3855 1.3886 1.3874 1.082 1.3853 1.0821 1.0811 1.3873 1.0819 1.3854 1.0827 1.386 1.0819 1.388 1.0818 1.0815 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 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 7 16 6 6 9 5 5 17 1 1 1 8 8 9 7 7 12 2 2 5 7 7 7 29 29 30 1 1 3 8 8 14 8 8 15 12 12 16 13 13 16 4 4 14 6 6 18 17 17 21 17 17 22 4 4 24 18 18 23 19 19 23 21 21 22 20 20 26 20 20 27 24 24 28 25 25 28 26 26 27 1 4 5 5 5 6 6 6 7 7 7 7 7 7 8 8 8 9 9 9 10 10 10 10 10 10 11 11 11 12 12 12 13 13 13 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25 26 26 26 27 27 27 28 28 28 11 20 9 11 11 17 34 34 8 9 10 9 10 10 12 13 13 5 7 7 29 30 31 30 31 31 3 5 5 14 32 32 15 33 33 16 35 35 16 36 36 14 15 15 18 19 19 21 37 37 22 38 38 24 25 25 23 39 39 23 40 40 22 41 41 26 42 42 27 43 43 28 44 44 28 45 45 27 46 46 111.479 120.1471 123.983 123.7647 112.2459 117.784 112.5736 115.4455 109.7787 103.4753 109.1268 108.8927 112.8919 112.2501 119.7288 121.7908 118.4802 127.7415 128.2172 104.026 109.9759 111.3418 110.1021 108.8554 108.318 108.1728 125.6287 107.7506 126.5803 120.927 120.4347 118.6193 121.0833 120.7357 118.1768 120.0227 120.442 119.5352 119.7294 119.3002 120.969 116.4292 123.7897 119.7557 118.4913 122.0198 119.4214 120.2342 120.0291 119.7367 119.7086 121.3242 118.9655 118.1161 121.0948 120.7314 120.6178 119.2174 120.1646 121.0996 118.8552 120.045 118.9178 120.5128 120.5694 119.4197 119.6222 120.9555 119.2868 120.2269 120.4852 120.4189 119.4605 120.1195 120.5208 119.4245 120.0534 119.6186 120.2178 120.1626 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 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 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 11 11 11 7 7 20 20 16 16 9 9 11 11 6 6 11 11 6 6 9 9 5 5 34 34 1 1 9 9 10 10 1 1 8 8 10 10 1 1 1 8 8 8 9 9 9 7 7 13 13 7 7 12 12 8 8 32 32 8 8 33 33 12 12 35 35 13 13 36 36 6 6 19 19 6 6 18 18 17 17 37 37 17 17 38 38 4 4 25 25 4 4 24 24 18 18 39 39 19 19 40 40 20 20 42 42 20 20 43 43 24 24 44 44 25 25 45 45 1 1 1 1 1 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 17 17 17 17 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 26 26 26 26 27 27 27 27 7 7 7 11 11 16 16 20 20 6 6 6 6 9 9 9 9 11 11 11 11 17 17 17 17 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 10 10 10 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 16 16 16 16 16 16 16 16 18 18 18 18 19 19 19 19 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 23 23 23 23 23 23 23 23 26 26 26 26 27 27 27 27 28 28 28 28 28 28 28 28 8 9 10 3 5 14 15 24 25 17 34 17 34 2 7 2 7 1 3 1 3 18 19 18 19 12 13 12 13 12 13 2 5 2 5 2 5 29 30 31 29 30 31 29 30 31 14 32 14 32 15 33 15 33 16 35 16 35 16 36 16 36 4 15 4 15 4 14 4 14 21 37 21 37 22 38 22 38 23 39 23 39 23 40 23 40 26 42 26 42 27 43 27 43 22 41 22 41 21 41 21 41 28 44 28 44 28 45 28 45 27 46 27 46 26 46 26 46 -106.4416 9.6626 129.347 176.3445 -5.8454 -160.0138 21.8273 -123.3562 59.3881 100.6494 -121.194 -78.3536 59.8029 6.4002 -172.2609 -174.4952 6.8436 178.0324 -4.1841 -1.0744 176.709 160.6021 -22.4043 23.615 -159.3914 174.8956 -5.2622 62.264 -117.8938 -63.1116 116.7306 171.7359 -9.6117 -71.534 107.1185 54.2148 -127.1328 64.0417 -56.7029 -176.6743 -58.3171 -179.0617 60.9669 178.144 57.3994 -62.572 -179.8428 -1.4487 0.3098 178.7039 -179.7929 -0.5521 0.0512 179.292 -0.4152 179.4472 -178.8379 1.0245 -0.304 179.2748 -179.5637 0.0151 -178.0813 0.1563 2.055 -179.7074 178.2999 0.1989 -1.2718 -179.3727 177.2936 -2.7227 0.22 -179.7963 -177.2776 2.2404 -0.3112 179.2068 -0.0223 179.7954 179.994 -0.1883 0.2093 -179.9821 -179.3202 0.4885 -176.9554 2.4652 0.3107 179.7313 177.3769 -2.2354 0.1928 -179.4195 -0.0827 179.908 -179.8987 0.092 -0.0112 179.9981 -179.8176 0.1917 -0.7192 179.6664 179.8682 0.2537 -0.2949 -179.8829 179.3163 -0.2716 0.6195 -179.7266 -179.7685 -0.1147 -0.1079 -179.7619 179.4775 -0.1765 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|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 752 A 724 A 1152 752 2488.9532096360 46 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=131 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= 724 RedAO= T EigKep= 1.02D-06 NBF= 724 NBsUse= 721 1.00D-06 EigRej= 7.85D-07 NBFU= 721 Berny optimization. local minimum Step number 52 out of a maximum of 257 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00014 0.00362 0.00420 0.00501 0.00669 0.00719 0.01352 0.01462 0.01708 0.01802 0.02011 0.02086 0.02133 0.02212 0.02218 0.02237 0.02250 0.02253 0.02259 0.02260 0.02263 0.02265 0.02267 0.02270 0.02271 0.02272 0.02274 0.02282 0.02286 0.02287 0.02298 0.02313 0.02348 0.02430 0.02502 0.02632 0.03821 0.04807 0.05438 0.05789 0.05868 0.07000 0.08063 0.11529 0.13448 0.13841 0.14735 0.15803 0.15925 0.15954 0.15988 0.15995 0.15998 0.16000 0.16001 0.16010 0.16015 0.16023 0.16049 0.16080 0.16091 0.16226 0.16264 0.20283 0.20696 0.21932 0.21991 0.22068 0.22118 0.22298 0.22935 0.23245 0.23611 0.23983 0.24520 0.24617 0.24952 0.25198 0.25213 0.26295 0.27526 0.28211 0.28866 0.30953 0.32329 0.34802 0.34953 0.35053 0.35351 0.35554 0.35693 0.35752 0.35756 0.35762 0.35765 0.35789 0.35813 0.35830 0.35852 0.35911 0.35965 0.36128 0.37173 0.41270 0.42306 0.42459 0.43224 0.43366 0.43463 0.44181 0.45105 0.45934 0.46074 0.46259 0.46843 0.47330 0.47505 0.47816 0.47919 0.48136 0.48176 0.48199 0.48476 0.48803 0.50505 0.51196 0.52500 0.55419 0.59757 0.67451 1.05372 1.09491 -2.07563184e-08 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 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 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 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 2.75605 2.55451 2.26804 2.25585 2.61273 2.61478 2.60762 2.62234 2.66220 2.68840 1.91268 2.88572 2.90791 2.87296 2.64361 2.64147 2.06110 2.06283 2.06008 2.62875 2.04593 2.62960 2.04419 2.62860 2.04627 2.62964 2.04681 2.64283 2.63956 2.62748 2.05071 2.63370 2.04493 2.63438 2.63680 2.63703 2.04862 2.63110 2.04854 2.04729 2.62983 2.04676 2.63516 2.04541 2.63770 2.04869 2.63285 2.04925 2.04738 1.93301 2.06277 2.16553 2.15305 1.96083 2.03367 1.93381 1.99323 1.91485 1.80475 1.89469 1.86412 2.00277 1.97208 2.08236 2.11588 2.08204 2.23655 2.22884 1.81651 1.91212 1.92472 1.91531 1.90795 1.90585 1.89771 2.19516 1.88386 2.20360 2.10316 2.09582 2.08296 2.10103 2.09539 2.08673 2.08577 2.11635 2.08070 2.08776 2.10967 2.08559 2.07476 2.10198 2.10609 2.06475 2.12808 2.08941 2.09441 2.09175 2.09703 2.08972 2.10876 2.08468 2.03180 2.14372 2.10693 2.10457 2.08198 2.09661 2.10857 2.07715 2.09742 2.07964 2.10094 2.10259 2.08462 2.07537 2.12319 2.07996 2.09896 2.10423 2.10396 2.08353 2.09569 2.10685 2.07965 2.09663 2.08403 2.09957 2.09959 -1.77821 0.20533 2.30386 3.04661 -0.12954 -1.96971 1.20020 -2.76259 0.42010 1.71871 -2.24633 -1.32228 0.99586 0.17616 -2.91365 -3.05626 0.13712 3.03883 -0.13754 -0.01270 3.09412 2.81995 -0.36848 0.52912 -2.65932 3.08831 0.02905 1.14339 -1.91588 -1.05667 2.16726 2.99340 -0.19967 -1.26984 1.82028 0.94851 -2.24456 1.12819 -0.97256 -3.06268 -1.02086 -3.12161 1.07146 3.11935 1.01860 -1.07152 -3.04188 0.04556 0.01900 3.10644 3.03918 -0.09348 -0.02010 3.13043 0.00533 3.11791 -3.08250 0.03007 -0.00311 -3.12513 3.12959 0.00756 3.14095 -0.02903 0.02778 3.14098 3.14070 0.02795 -0.02018 -3.13294 3.10161 -0.03969 0.00580 -3.13551 -3.10481 0.04375 -0.01070 3.13785 0.00133 3.13682 -3.14055 -0.00506 0.00863 -3.12353 -3.13983 0.01120 -3.10598 0.03623 -0.00455 3.13766 3.10611 -0.02620 0.00732 -3.12498 -0.00347 3.13328 -3.13892 -0.00216 -0.00153 -3.13827 3.13052 -0.00623 -0.00153 -3.13925 3.13943 0.00171 -0.00409 -3.13498 3.12819 -0.00270 0.00470 -3.13937 -3.14079 -0.00167 -0.00186 -3.14098 3.12893 -0.01019 0.00001 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00001 -0.00001 -0.00001 0.00001 0.00000 -0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00000 -0.00001 -0.00000 0.00001 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00001 -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 -0.00001 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 0.00001 -0.00001 0.00000 0.00000 -0.00001 0.00000 -0.00000 0.00000 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 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 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 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00007 -0.00000 -0.00001 -0.00001 0.00002 0.00002 -0.00003 0.00001 0.00001 -0.00003 -0.00001 -0.00001 -0.00001 -0.00002 -0.00002 0.00002 -0.00000 -0.00000 -0.00000 0.00002 0.00000 -0.00002 -0.00000 -0.00002 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00002 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00000 -0.00001 -0.00001 -0.00001 -0.00000 0.00001 0.00000 -0.00000 -0.00001 -0.00008 -0.00002 0.00001 0.00001 0.00005 0.00005 0.00005 0.00001 -0.00000 -0.00001 -0.00004 0.00003 0.00001 -0.00001 -0.00001 0.00001 -0.00000 -0.00001 0.00001 0.00001 -0.00000 0.00001 0.00000 -0.00000 -0.00001 -0.00001 0.00000 0.00001 -0.00000 0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00000 -0.00000 0.00001 -0.00001 0.00001 -0.00002 0.00001 0.00000 0.00000 -0.00001 -0.00000 -0.00000 0.00000 0.00001 -0.00000 -0.00000 0.00001 -0.00002 0.00001 0.00001 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00001 0.00001 0.00000 -0.00000 -0.00001 0.00001 0.00000 -0.00000 -0.00000 -0.00000 0.00001 -0.00001 -0.00000 0.00000 -0.00000 0.00003 -0.00002 -0.00001 -0.00004 -0.00005 -0.00013 -0.00020 0.00023 0.00027 0.00007 0.00024 0.00022 0.00040 -0.00000 0.00003 -0.00014 -0.00011 -0.00003 -0.00004 0.00010 0.00010 0.00009 0.00012 -0.00009 -0.00006 0.00009 0.00020 0.00011 0.00022 0.00010 0.00022 0.00011 0.00007 0.00010 0.00007 0.00012 0.00009 0.00002 0.00001 0.00002 -0.00001 -0.00001 -0.00000 0.00001 0.00001 0.00002 0.00013 0.00013 0.00002 0.00002 -0.00013 -0.00016 -0.00001 -0.00005 0.00000 -0.00002 -0.00000 -0.00002 -0.00001 0.00003 0.00002 0.00006 -0.00009 -0.00003 -0.00007 -0.00000 0.00010 0.00003 0.00006 -0.00001 0.00007 0.00005 0.00004 0.00002 -0.00006 -0.00005 -0.00003 -0.00002 -0.00002 -0.00002 0.00000 0.00000 -0.00000 0.00006 -0.00001 0.00005 0.00004 0.00005 -0.00001 0.00000 -0.00003 0.00001 0.00001 0.00005 -0.00001 -0.00003 -0.00001 -0.00002 0.00002 0.00003 -0.00004 -0.00003 0.00000 0.00001 -0.00001 -0.00000 -0.00001 0.00005 -0.00005 0.00001 -0.00001 -0.00002 -0.00001 -0.00002 0.00001 0.00002 -0.00005 -0.00004 -0.00003 -0.00001 0.00001 0.00001 -0.00002 -0.00002 0.00000 -0.00000 0.00002 -0.00000 0.00000 0.00002 0.00005 0.00000 -0.00000 0.00002 0.00001 0.00001 0.00000 0.00002 -0.00000 -0.00001 -0.00000 -0.00001 0.00000 0.00002 0.00001 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00002 0.00002 0.00001 0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 0.00001 0.00001 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00002 0.00006 0.00001 -0.00001 -0.00001 -0.00002 0.00001 0.00001 -0.00002 -0.00001 -0.00000 -0.00000 0.00002 0.00001 0.00002 -0.00001 -0.00001 0.00001 0.00000 -0.00000 -0.00000 0.00001 0.00000 -0.00000 -0.00001 0.00000 0.00002 0.00000 -0.00002 0.00001 0.00001 -0.00002 0.00000 -0.00000 0.00000 0.00000 -0.00001 0.00001 0.00001 0.00001 -0.00002 0.00003 -0.00002 -0.00001 0.00002 -0.00003 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00001 0.00000 -0.00001 0.00004 -0.00003 -0.00000 -0.00000 0.00001 -0.00000 -0.00000 0.00001 0.00000 0.00000 -0.00000 0.00002 -0.00000 -0.00002 0.00001 0.00001 -0.00002 0.00000 -0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00000 0.00003 0.00001 0.00002 -0.00006 -0.00005 -0.00011 0.00002 -0.00018 -0.00009 -0.00005 -0.00005 0.00002 0.00002 0.00012 0.00000 0.00006 -0.00005 0.00001 0.00002 0.00006 0.00008 -0.00011 -0.00017 -0.00011 -0.00017 0.00005 0.00005 0.00007 0.00006 0.00004 0.00004 -0.00009 0.00002 -0.00012 0.00000 -0.00009 0.00003 -0.00008 -0.00008 -0.00008 -0.00006 -0.00006 -0.00007 -0.00008 -0.00008 -0.00009 0.00003 -0.00002 0.00003 -0.00001 -0.00003 0.00001 -0.00003 0.00000 0.00001 -0.00000 0.00005 0.00004 -0.00000 0.00001 -0.00004 -0.00002 0.00008 -0.00004 0.00009 -0.00003 -0.00009 0.00004 -0.00010 0.00003 -0.00007 -0.00007 -0.00001 -0.00001 0.00007 0.00006 0.00001 -0.00000 0.00000 0.00001 0.00000 0.00001 -0.00000 -0.00006 0.00001 -0.00005 0.00008 0.00007 -0.00000 -0.00002 -0.00009 -0.00013 0.00001 -0.00003 0.00000 0.00002 -0.00001 0.00000 -0.00000 -0.00002 0.00005 0.00004 -0.00001 0.00001 0.00001 0.00002 -0.00000 -0.00004 0.00004 -0.00000 0.00001 0.00004 -0.00000 0.00002 -0.00000 -0.00003 0.00004 0.00001 0.00004 -0.00001 -0.00001 0.00000 -0.00000 0.00000 -0.00002 0.00001 0.00003 -0.00003 -0.00001 0.00001 0.00003 -0.00002 -0.00002 0.00003 0.00000 0.00000 0.00000 0.00003 -0.00000 -0.00003 -0.00000 -0.00003 -0.00000 0.00002 0.00001 0.00001 0.00000 0.00001 0.00000 -0.00000 -0.00000 0.00000 0.00002 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00000 0.00001 0.00000 -0.00000 0.00001 -0.00003 -0.00001 -0.00000 0.00000 0.00003 0.00005 0.00006 -0.00001 -0.00001 -0.00002 -0.00004 0.00005 0.00002 0.00001 -0.00001 -0.00000 0.00000 -0.00001 0.00001 0.00001 0.00000 0.00001 -0.00000 -0.00001 -0.00001 0.00000 0.00001 -0.00001 0.00000 0.00002 -0.00002 -0.00001 0.00000 0.00000 -0.00000 -0.00001 0.00001 0.00001 0.00002 -0.00003 0.00004 -0.00004 -0.00000 0.00003 -0.00002 -0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00000 -0.00000 0.00002 -0.00002 0.00000 -0.00001 0.00000 -0.00000 -0.00000 0.00001 -0.00000 -0.00000 0.00000 0.00001 0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00001 -0.00002 0.00001 0.00000 -0.00000 -0.00000 -0.00001 0.00001 -0.00000 0.00005 -0.00000 0.00001 -0.00010 -0.00010 -0.00024 -0.00018 0.00004 0.00018 0.00002 0.00020 0.00024 0.00042 0.00012 0.00004 -0.00008 -0.00016 -0.00003 -0.00002 0.00017 0.00018 -0.00003 -0.00005 -0.00020 -0.00023 0.00014 0.00025 0.00017 0.00028 0.00015 0.00026 0.00001 0.00010 -0.00002 0.00007 0.00003 0.00011 -0.00006 -0.00007 -0.00006 -0.00007 -0.00008 -0.00007 -0.00007 -0.00008 -0.00007 0.00016 0.00012 0.00005 0.00001 -0.00016 -0.00015 -0.00005 -0.00004 0.00001 -0.00002 0.00005 0.00002 -0.00001 0.00004 -0.00001 0.00004 -0.00001 -0.00007 0.00002 -0.00004 0.00001 0.00007 -0.00004 0.00002 0.00000 -0.00001 0.00003 0.00001 0.00000 0.00001 -0.00002 -0.00002 -0.00001 -0.00000 0.00001 0.00002 -0.00001 0.00000 -0.00001 -0.00000 0.00012 0.00011 -0.00001 -0.00002 -0.00012 -0.00012 0.00002 0.00002 -0.00001 -0.00001 -0.00002 -0.00002 0.00002 0.00002 0.00001 0.00001 -0.00000 0.00001 0.00000 0.00002 -0.00002 0.00000 -0.00002 0.00000 0.00000 0.00002 -0.00001 0.00000 0.00001 -0.00001 -0.00001 -0.00003 2.75608 2.55450 2.26803 2.25585 2.61273 2.61478 2.60760 2.62235 2.66222 2.68837 1.91267 2.88573 2.90795 2.87294 2.64359 2.64150 2.06110 2.06283 2.06008 2.62878 2.04593 2.62958 2.04419 2.62857 2.04627 2.62966 2.04681 2.64283 2.63957 2.62748 2.05071 2.63370 2.04493 2.63439 2.63682 2.63704 2.04862 2.63111 2.04854 2.04730 2.62984 2.04676 2.63516 2.04541 2.63769 2.04870 2.63286 2.04925 2.04738 1.93301 2.06274 2.16551 2.15304 1.96083 2.03370 1.93386 1.99329 1.91484 1.80474 1.89467 1.86408 2.00282 1.97210 2.08237 2.11587 2.08204 2.23655 2.22883 1.81652 1.91213 1.92472 1.91532 1.90795 1.90585 1.89770 2.19516 1.88386 2.20359 2.10316 2.09583 2.08294 2.10103 2.09539 2.08673 2.08576 2.11634 2.08072 2.08777 2.10968 2.08556 2.07480 2.10194 2.10609 2.06478 2.12805 2.08940 2.09440 2.09175 2.09703 2.08973 2.10876 2.08468 2.03180 2.14374 2.10691 2.10458 2.08198 2.09661 2.10857 2.07715 2.09743 2.07964 2.10094 2.10260 2.08463 2.07538 2.12317 2.07997 2.09896 2.10422 2.10396 2.08351 2.09570 2.10686 2.07965 2.09663 2.08402 2.09958 2.09958 -1.77816 0.20533 2.30387 3.04651 -0.12964 -1.96995 1.20002 -2.76254 0.42027 1.71873 -2.24614 -1.32204 0.99628 0.17628 -2.91361 -3.05633 0.13696 3.03880 -0.13756 -0.01253 3.09430 2.81993 -0.36854 0.52892 -2.65954 3.08845 0.02930 1.14356 -1.91559 -1.05652 2.16751 2.99341 -0.19958 -1.26986 1.82034 0.94854 -2.24444 1.12813 -0.97263 -3.06274 -1.02093 -3.12169 1.07139 3.11928 1.01852 -1.07159 -3.04172 0.04568 0.01905 3.10645 3.03902 -0.09363 -0.02015 3.13038 0.00534 3.11789 -3.08245 0.03009 -0.00312 -3.12509 3.12958 0.00760 3.14095 -0.02910 0.02780 3.14094 3.14071 0.02802 -0.02022 -3.13292 3.10162 -0.03971 0.00582 -3.13550 -3.10480 0.04375 -0.01072 3.13783 0.00131 3.13682 -3.14055 -0.00504 0.00862 -3.12353 -3.13984 0.01119 -3.10586 0.03635 -0.00456 3.13765 3.10599 -0.02632 0.00734 -3.12497 -0.00348 3.13327 -3.13894 -0.00219 -0.00151 -3.13825 3.13053 -0.00621 -0.00153 -3.13923 3.13944 0.00173 -0.00410 -3.13498 3.12817 -0.00270 0.00470 -3.13935 -3.14081 -0.00167 -0.00185 -3.14099 3.12892 -0.01022 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000012 0.000003 0.001189 0.000306 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -7.890856e-09 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 1 1 2 3 4 4 5 5 5 6 6 7 7 7 8 8 10 10 10 12 12 13 13 14 14 15 15 17 17 18 18 19 19 20 20 21 21 22 22 23 24 24 25 25 26 26 27 27 28 7 11 9 11 16 20 6 9 11 17 34 8 9 10 12 13 29 30 31 14 32 15 33 16 35 16 36 18 19 21 37 22 38 24 25 23 39 23 40 41 26 42 27 43 28 44 28 45 46 1.4584 1.3518 1.2002 1.1937 1.3826 1.3837 1.3799 1.3877 1.4088 1.4226 1.0121 1.5271 1.5388 1.5203 1.3989 1.3978 1.0907 1.0916 1.0901 1.3911 1.0827 1.3915 1.0817 1.391 1.0828 1.3915 1.0831 1.3985 1.3968 1.3904 1.0852 1.3937 1.0821 1.3941 1.3953 1.3955 1.0841 1.3923 1.084 1.0834 1.3916 1.0831 1.3945 1.0824 1.3958 1.0841 1.3932 1.0844 1.0834 -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 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 7 16 6 6 9 5 5 17 1 1 1 8 8 9 7 7 12 2 2 5 7 7 7 29 29 30 1 1 3 8 8 14 8 8 15 12 12 16 13 13 16 4 4 14 6 6 18 17 17 21 17 17 22 4 4 24 18 18 23 19 19 23 21 21 22 20 20 26 20 20 27 24 24 28 25 25 28 26 26 27 1 4 5 5 5 6 6 6 7 7 7 7 7 7 8 8 8 9 9 9 10 10 10 10 10 10 11 11 11 12 12 12 13 13 13 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25 26 26 26 27 27 27 28 28 28 11 20 9 11 11 17 34 34 8 9 10 9 10 10 12 13 13 5 7 7 29 30 31 30 31 31 3 5 5 14 32 32 15 33 33 16 35 35 16 36 36 14 15 15 18 19 19 21 37 37 22 38 38 24 25 25 23 39 39 23 40 40 22 41 41 26 42 42 27 43 43 28 44 44 28 45 45 27 46 46 110.7531 118.1879 124.0755 123.3606 112.347 116.5205 110.7992 114.2037 109.7128 103.4047 108.5575 106.806 114.7503 112.992 119.3107 121.2309 119.2923 128.1447 127.7032 104.0781 109.5564 110.2782 109.739 109.3173 109.1974 108.731 125.7734 107.9371 126.2568 120.5019 120.0814 119.3448 120.3804 120.0568 119.5608 119.5058 121.2581 119.2156 119.6201 120.8749 119.4956 118.8753 120.4347 120.6699 118.3017 121.93 119.7142 120.0007 119.8482 120.151 119.7323 120.8233 119.4433 116.4136 122.826 120.7181 120.5831 119.2889 120.127 120.8122 119.012 120.1735 119.1548 120.3748 120.4698 119.4402 118.9101 121.6497 119.1728 120.2615 120.5636 120.5478 119.3775 120.0744 120.7138 119.1552 120.1281 119.4059 120.2966 120.2974 -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 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 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 11 11 11 7 7 20 20 16 16 9 9 11 11 6 6 11 11 6 6 9 9 5 5 34 34 1 1 9 9 10 10 1 1 8 8 10 10 1 1 1 8 8 8 9 9 9 7 7 13 13 7 7 12 12 8 8 32 32 8 8 33 33 12 12 35 35 13 13 36 36 6 6 19 19 6 6 18 18 17 17 37 37 17 17 38 38 4 4 25 25 4 4 24 24 18 18 39 39 19 19 40 40 20 20 42 42 20 20 43 43 24 24 44 44 25 25 45 1 1 1 1 1 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 17 17 17 17 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 26 26 26 26 27 27 27 7 7 7 11 11 16 16 20 20 6 6 6 6 9 9 9 9 11 11 11 11 17 17 17 17 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 10 10 10 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 16 16 16 16 16 16 16 16 18 18 18 18 19 19 19 19 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 23 23 23 23 23 23 23 23 26 26 26 26 27 27 27 27 28 28 28 28 28 28 28 8 9 10 3 5 14 15 24 25 17 34 17 34 2 7 2 7 1 3 1 3 18 19 18 19 12 13 12 13 12 13 2 5 2 5 2 5 29 30 31 29 30 31 29 30 31 14 32 14 32 15 33 15 33 16 35 16 35 16 36 16 36 4 15 4 15 4 14 4 14 21 37 21 37 22 38 22 38 23 39 23 39 23 40 23 40 26 42 26 42 27 43 27 43 22 41 22 41 21 41 21 41 28 44 28 44 28 45 28 45 27 46 27 46 26 46 26 -101.8837 11.7647 132.0013 174.5579 -7.4222 -112.8562 68.7667 -158.2845 24.0698 98.475 -128.7053 -75.7608 57.0588 10.0931 -166.9398 -175.1106 7.8565 174.112 -7.8802 -0.7276 177.2801 161.5713 -21.1126 30.3162 -152.3677 176.9474 1.6645 65.5112 -109.7717 -60.5425 124.1746 171.5089 -11.4404 -72.7566 104.2941 54.3458 -128.6035 64.6405 -55.7236 -175.4785 -58.491 -178.8552 61.39 178.7255 58.3614 -61.3935 -174.2868 2.6105 1.0885 177.9858 174.132 -5.356 -1.1518 179.3603 0.3056 178.6432 -176.6144 1.7231 -0.1779 -179.057 179.3126 0.4334 179.9634 -1.6634 1.5916 179.9649 179.9491 1.6012 -1.1562 -179.5041 177.7094 -2.2742 0.332 -179.6516 -177.8924 2.5065 -0.6133 179.7857 0.076 179.7266 -179.9404 -0.2898 0.4942 -178.9651 -179.8992 0.6415 -177.9593 2.0759 -0.2606 179.7747 177.9667 -1.5011 0.4195 -179.0483 -0.1989 179.5236 -179.8466 -0.124 -0.0874 -179.8097 179.3656 -0.3567 -0.0874 -179.8657 179.8763 0.0981 -0.2342 -179.6211 179.232 -0.1549 0.2691 -179.8725 -179.9541 -0.0958 -0.1064 -179.9648 179.2746 -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|-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 -0.0489938319 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:1.9277,-2.1366,1.2001;2.741,-1.2411,-2.0687;3.1303,-.6932,2.4296;-3.7231,-.7023,-1.2624;3.11,-.618,.1235;3.9093,.4617,-.0705;1.5989,-2.3098,-.1818;.1705,-1.8624,-.4296;2.5475,-1.3516,-.8958;1.8409,-3.7561,-.5731;2.7489,-1.0985,1.3811;-.3318,-1.8418,-1.7299;-.6642,-1.4712,.6091;-1.6267,-1.4361,-1.984;-1.9699,-1.0687,.3661;-2.4531,-1.0487,-.9346;3.3381,1.7331,.0794;4.1823,2.8197,.2932;1.9687,1.945,-.0402;-4.4694,.0617,-.4073;3.6618,4.0978,.3902;1.4611,3.2311,.0611;2.2963,4.3152,.2759;-5.6878,-.4394,.0218;-4.0484,1.3282,-.0239;-6.4954,.3391,.8381;-4.8594,2.0915,.8001;-6.0831,1.6014,1.2349;1.1681,-4.409,-.0191;2.8692,-4.0554,-.3695;1.6518,-3.8926,-1.6357;.2974,-2.1201,-2.565;-.3161,-1.4841,1.6323;4.8228,.3459,.3407;-2.0056,-1.4146,-2.9972;-2.5988,-.781,1.198;5.2512,2.6662,.3845;1.2861,1.1248,-.2193;4.3324,4.9297,.5598;.3935,3.3801,-.0338;1.8912,5.3145,.3534;-6.0001,-1.4268,-.2914;-3.0989,1.7155,-.3717;-7.4494,-.0495,1.1692;-4.5344,3.0792,1.0986;-6.7133,2.2037,1.8749; 0.000000 3.485427 0.000000 2.245270 4.548214 0.000000 6.328764 6.536461 7.784650 0.000000 2.205235 2.308739 2.307382 6.972816 0.000000 3.506025 2.873553 2.862005 7.812192 1.357271 0.000000 1.430980 2.450890 3.431881 5.663513 2.288880 3.609922 0.000000 2.412173 3.111293 4.278096 4.147315 3.239648 4.416929 1.517110 0.000000 2.322262 1.193907 3.439636 6.314802 1.376083 2.413234 1.525681 2.475532 0.000000 2.403062 3.061392 4.478867 6.384313 3.456002 4.724496 1.517792 2.529181 2.526865 0.000000 1.335928 3.452774 1.187018 7.002323 1.393888 2.426533 2.287438 3.241934 2.299749 3.421464 0.000000 3.711768 3.149182 5.532340 3.608095 4.096210 5.103586 2.518556 1.394181 3.037463 3.118245 4.440902 0.000000 2.740429 4.338038 4.279938 3.667546 3.899818 5.011508 2.539676 1.388706 3.548755 3.590781 3.519111 2.391387 0.000000 4.823190 4.372871 6.531545 2.335416 5.248601 6.157196 3.796795 2.414169 4.314552 4.404251 5.530290 1.380581 2.766184 0.000000 4.126467 5.305719 5.514680 2.420724 5.105696 6.090865 3.817954 2.417572 4.698871 4.756774 4.826867 2.770291 1.387837 2.403271 0.000000 4.993238 5.319981 6.528345 1.356584 5.679276 6.596157 4.309966 2.793015 5.009947 5.089167 5.694419 2.400362 2.400391 1.390795 1.387688 0.000000 4.268421 3.717089 3.384294 7.588945 2.362515 1.401917 4.408817 4.818738 3.330365 5.727019 3.171687 5.433316 5.154247 6.241030 6.008908 6.504205 0.000000 5.519969 4.913845 4.243954 8.793180 3.604990 2.401447 5.762877 6.207971 4.635274 7.033751 4.311659 6.796967 6.480746 7.552606 7.278365 7.778233 1.392512 0.000000 4.266059 3.855210 3.795937 6.395255 2.810382 2.442794 4.273149 4.228686 3.454651 5.727402 3.448440 4.742058 4.361697 5.304481 4.975978 5.414350 1.390787 2.403351 0.000000 6.952695 7.513194 8.147038 1.368197 7.628391 8.395099 6.519142 5.023177 7.174502 7.377260 7.526561 4.742689 4.226463 3.579207 2.850168 2.361484 7.999219 9.107667 6.717999 0.000000 6.521506 5.949590 5.234027 8.961501 4.755394 3.673521 6.755671 6.955927 5.708849 8.119549 5.368114 7.464666 7.055184 8.014273 7.642572 8.101444 2.406876 1.383435 2.772368 9.112751 0.000000 5.507015 5.116138 4.878162 6.640730 4.187889 3.698805 5.547893 5.277359 4.805940 7.026221 4.706021 5.670624 5.189322 5.958157 5.509359 5.884662 2.401551 2.761922 1.386371 6.740578 2.387985 0.000000 6.528030 6.047081 5.515243 7.985916 5.002137 4.191832 6.677242 6.571113 5.792085 8.128589 5.543863 6.988409 6.508302 7.319445 6.869842 7.265920 2.791240 2.407042 2.413486 8.020830 1.387393 1.385256 0.000000 7.890808 8.721080 9.144448 2.361819 8.800228 9.639789 7.525630 6.045552 8.336296 8.248387 8.570878 5.807086 5.161999 4.637789 3.786419 3.427669 9.283797 10.397770 8.019429 1.385486 10.398826 8.036181 9.296010 0.000000 7.015461 7.541758 7.851077 2.400559 7.419722 8.004905 6.719457 5.305094 7.172654 7.799724 7.352963 5.174217 4.437381 4.165088 3.196421 3.003980 7.398244 8.370718 6.048647 1.388626 8.202936 5.829427 7.019013 2.411256 0.000000 8.786842 9.811097 9.810835 3.630749 9.679408 10.445068 8.577504 7.133599 9.361546 9.394471 9.371143 7.024352 6.110046 5.900852 4.762811 4.626927 9.960714 10.975583 8.659777 2.394275 10.839576 8.501360 9.665363 1.387327 2.776599 0.000000 8.006340 8.780808 8.616559 3.653852 8.444583 8.961327 7.876825 6.515058 8.342244 8.998582 8.270416 6.509333 5.507210 5.535875 4.303965 4.319764 8.236884 9.085125 6.881195 2.393736 8.763759 6.464777 7.511557 2.774419 1.385444 2.397690 0.000000 8.840034 9.841622 9.569679 4.136772 9.522281 10.141568 8.735906 7.340022 9.367298 9.734527 9.236575 7.329600 6.260744 6.280678 4.980153 4.990603 9.492631 10.380202 8.159357 2.769681 10.094907 7.806910 8.859902 2.406786 2.408152 1.385956 1.388003 0.000000 2.688358 4.087769 4.863478 6.261737 4.261814 5.589290 2.149113 2.765564 3.466785 1.088921 3.926675 3.430297 3.518833 4.528755 4.599263 5.024234 6.514855 7.838119 6.404242 7.205538 8.874145 7.646108 8.801731 7.922287 7.754159 9.055827 8.902698 9.501391 0.000000 2.651838 3.289982 4.382701 7.449816 3.481003 4.644971 2.167135 3.477890 2.773300 1.090156 3.438440 4.122770 4.485610 5.448000 5.734041 6.138992 5.824835 7.030705 6.076579 8.414772 8.226811 7.433856 8.415001 9.297917 8.772472 10.414703 9.944066 10.710610 1.772423 0.000000 3.346856 2.899008 5.380396 6.261598 3.993058 5.148409 2.149911 2.787583 2.794007 1.087862 4.255798 2.854732 4.033102 4.111515 5.009871 5.042827 6.118304 7.428242 6.060027 7.390247 8.484715 7.325494 8.452063 8.279009 7.896025 9.508114 9.172730 9.912257 1.764599 1.763982 0.000000 4.102934 2.643872 5.916697 4.457768 4.170783 5.092571 2.722035 2.154683 2.905136 3.004404 4.756616 1.081975 3.379409 2.123123 3.851954 3.372183 5.575454 6.903850 5.068849 5.669134 7.662516 6.073382 7.312944 6.733422 6.101967 7.985694 7.460208 8.306583 3.532463 3.896101 2.416568 0.000000 2.376386 4.806495 3.624756 4.538593 3.842535 4.953797 2.764011 2.152042 3.822159 3.831271 3.099344 3.381278 1.080935 3.846824 2.123969 3.368362 5.110269 6.367995 4.447076 4.878537 6.965897 5.278305 6.503556 5.704430 4.958059 6.491417 5.841159 6.552576 3.672189 4.556909 4.511492 4.289349 0.000000 3.909351 3.557762 2.882346 8.757967 1.977337 1.008407 4.209443 5.207104 3.096362 5.153009 2.733146 5.970180 5.786305 7.083514 6.938538 7.517378 2.048672 2.555782 3.293632 9.326654 3.927715 4.438905 4.705594 10.544729 8.932859 11.329145 9.849039 11.014271 6.007933 4.867552 5.650344 5.916379 5.605873 0.000000 5.797377 4.839677 7.506545 2.542984 6.045113 6.860964 4.660485 3.395438 5.015050 5.114143 6.471094 2.142472 3.848093 1.081931 3.381206 2.142064 6.923036 8.188169 5.985515 3.867523 8.601162 6.553907 7.877181 4.860438 4.531724 6.159843 5.903980 6.605505 5.282748 6.135335 4.622878 2.447127 4.928689 7.801815 0.000000 4.725148 6.276688 5.860664 2.706324 5.811387 6.746096 4.675623 3.389362 5.585161 5.630209 5.360257 3.851983 2.136838 3.391113 1.081858 2.154329 6.543601 7.730934 5.461397 2.605116 7.978112 5.820025 7.126274 3.322961 2.836079 4.070312 3.676947 4.221048 5.369651 6.563416 5.981634 4.933740 2.427711 7.555517 4.284094 0.000000 5.897283 5.252338 4.468370 9.726203 3.929235 2.620650 6.198468 6.854588 5.009237 7.334444 4.629060 7.480843 7.222285 8.351377 8.129911 8.654396 2.150382 1.083772 3.387559 10.094672 2.139119 3.845672 3.385656 11.377125 9.404263 11.983535 10.135498 11.415939 8.178834 7.171036 7.749559 7.493291 7.055324 2.359941 8.986184 8.612141 0.000000 3.614224 3.336837 3.704421 5.433068 2.545879 2.709887 3.448923 3.195616 2.860272 4.925029 3.105493 3.701299 3.350932 4.261040 3.969291 4.383745 2.161021 3.394643 1.082093 5.855868 3.854128 2.132129 3.382984 7.151162 5.341885 7.892176 6.304006 7.526337 5.538587 5.418802 5.226278 4.124195 3.577922 3.664537 5.000032 4.553357 4.296920 0.000000 7.491692 6.893534 6.046378 9.996618 5.697506 4.532081 7.773830 8.027074 6.690272 9.106871 6.286645 8.535258 8.120411 9.083288 8.702783 9.166187 3.382009 2.132118 3.854308 10.104746 1.081996 3.373244 2.145738 11.380761 9.140550 11.764085 9.623062 10.955199 9.877212 9.150856 9.478373 8.703216 7.993537 4.615174 9.647469 9.003475 2.449155 4.936116 0.000000 5.857479 5.568394 5.490913 5.926422 4.836195 4.569417 5.818009 5.262197 5.269872 7.301467 5.254310 5.538125 5.006754 5.574997 5.053475 5.341290 3.375748 3.843919 2.130909 5.899129 3.372853 1.082052 2.142599 7.181507 4.892945 7.580606 5.472600 6.835187 7.827503 7.844054 7.552606 6.055465 5.190399 5.381926 6.125930 5.271311 4.927682 2.432618 4.274183 0.000000 7.499145 7.040265 6.476010 8.386515 6.060779 5.272850 7.648631 7.421769 6.813847 9.117982 6.551250 7.777812 7.255468 7.963052 7.460142 7.811714 3.872362 3.387792 3.393322 8.284211 2.148679 2.147347 1.081124 9.521455 7.163192 9.763439 7.493851 8.840412 9.757455 9.448584 9.422602 8.144402 7.261484 5.769039 8.467178 7.617695 4.278385 4.271815 2.480004 2.476866 0.000000 8.098083 8.921897 9.555457 2.579227 9.155396 10.090226 7.650897 6.187548 8.569274 8.184546 8.913495 5.862752 5.411562 4.689537 4.099128 3.624597 9.865286 11.047880 8.656467 2.138232 11.150660 8.802812 10.105553 1.081943 3.386866 2.153934 3.856292 3.392092 7.768592 9.250994 8.151053 6.731184 6.001021 10.985353 4.824690 3.768858 11.991785 7.720352 12.161064 8.003206 10.398728 0.000000 6.525012 6.762102 7.242382 2.651163 6.651421 7.125919 6.189322 4.847075 6.446986 7.374329 6.722183 4.707019 4.128539 3.833998 3.093589 2.893885 6.452798 7.394427 5.083666 2.148120 7.208523 4.824734 6.023803 3.391208 1.082737 3.859283 2.147975 3.391027 7.472648 8.301932 7.457749 5.572935 4.690144 8.070763 4.229221 2.991076 8.438088 4.427220 8.150114 3.883620 6.195175 4.277499 0.000000 9.606582 10.758578 10.673910 4.497068 10.626255 11.437579 9.423602 7.994085 10.290595 10.153017 10.254251 7.891600 6.955117 6.765254 5.630965 5.512402 10.987871 12.012262 9.702601 3.373052 11.885420 9.559583 10.715663 2.138146 3.858510 1.081923 3.380485 2.143909 9.730263 11.175341 10.269788 8.845569 7.290828 12.306460 6.989766 4.905477 13.011375 8.922663 12.805245 8.644069 10.802000 2.476008 4.941179 0.000000 8.305047 9.034867 8.645840 4.531285 8.547380 8.917157 8.264229 6.992263 8.588544 9.495317 8.401173 7.062513 5.993732 6.192380 4.931339 5.050290 8.051510 8.757699 6.698820 3.373010 8.289568 6.086512 6.990223 3.856192 2.135956 3.379577 1.081783 2.144935 9.478438 10.386166 9.713516 7.987604 6.237220 9.777698 6.585235 4.319465 9.820384 6.279712 9.073929 5.065353 6.844007 4.938045 2.466210 4.276704 0.000000 9.693295 10.807500 10.275980 5.218118 10.369505 10.938899 9.679508 8.320503 10.299443 10.709161 10.033989 8.371649 7.190196 7.349341 5.956868 6.051477 10.221285 11.027001 8.894470 3.851151 10.650515 8.435974 9.390823 3.386974 3.387299 2.144571 2.145831 1.081471 10.460918 11.663548 10.929970 9.357247 7.388006 11.785022 7.680632 5.127909 12.065864 8.339013 11.452896 7.452115 9.275177 4.287414 4.283576 2.473164 2.473161 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:1.8813,-1.958,1.5762;2.6962,-1.7027,-1.803;3.147,-.3614,2.5194;-3.7362,-.7843,-1.092;3.1081,-.7058,.2382;3.9443,.2898,-.151;1.5335,-2.367,.2497;.1202,-1.9189,-.0717;2.5097,-1.5909,-.6291;1.719,-3.8685,.1275;2.7414,-.9359,1.5632;-.3931,-2.1161,-1.3529;-.6901,-1.3144,.8804;-1.6747,-1.7151,-1.6733;-1.9825,-.9141,.5715;-2.4767,-1.1127,-.7098;3.4212,1.5878,-.2335;4.3064,2.6627,-.2232;2.0594,1.8257,-.3862;-4.4462,.1499,-.3883;3.8337,3.9558,-.3591;1.5999,3.1269,-.5194;2.476,4.1998,-.5076;-5.678,-.2188,.1278;-3.9758,1.4483,-.2429;-6.4491,.7248,.791;-4.7507,2.3785,.4306;-5.9874,2.0218,.9503;1.0281,-4.3841,.7927;2.7376,-4.1642,.3795;1.5152,-4.1886,-.892;.2177,-2.565,-2.1249;-.3332,-1.1542,1.8881;4.8568,.2165,.2721;-2.062,-1.8639,-2.6725;-2.5927,-.4566,1.3389;5.3698,2.4884,-.1081;1.3457,1.0127,-.4114;4.5358,4.7789,-.3454;.5377,3.2961,-.6372;2.1083,5.2111,-.6122;-6.029,-1.2343,.0004;-3.0161,1.73,-.6577;-7.4134,.439,1.1896;-4.3872,3.3911,.5435;-6.5892,2.7536,1.4717; 0.2583553 0.1085435 0.0864075 -19.19697 -19.17791 -19.13544 -19.13186 -14.41950 -14.38425 -10.35085 -10.31017 -10.28025 -10.25313 -10.24792 -10.22819 -10.20174 -10.19316 -10.19244 -10.19058 -10.18999 -10.18929 -10.18856 -10.18800 -10.18677 -10.18668 -10.18445 -10.18140 -10.18106 -10.18027 -10.17898 -10.17239 -1.17147 -1.10875 -1.09464 -1.07433 -1.04590 -0.90682 -0.88990 -0.87482 -0.85521 -0.83004 -0.78246 -0.77115 -0.76779 -0.76108 -0.75622 -0.74358 -0.70195 -0.67205 -0.66690 -0.64543 -0.64049 -0.63287 -0.62981 -0.60434 -0.60061 -0.57335 -0.56753 -0.56175 -0.54073 -0.51694 -0.50941 -0.50081 -0.49671 -0.49276 -0.48608 -0.47039 -0.46679 -0.46146 -0.45790 -0.45282 -0.45183 -0.44471 -0.44266 -0.43845 -0.43545 -0.43228 -0.42691 -0.42104 -0.41631 -0.40828 -0.40075 -0.39177 -0.38245 -0.38137 -0.37441 -0.37258 -0.35804 -0.35648 -0.34695 -0.33902 -0.33486 -0.32610 -0.31442 -0.29300 -0.27899 -0.27275 -0.26741 -0.26554 -0.23983 -0.23082 -0.04370 -0.03781 -0.02611 -0.02214 -0.02002 -0.01157 -0.00933 -0.00896 -0.00248 0.00486 0.00835 0.01657 0.02114 0.02194 0.02572 0.02787 0.03369 0.03747 0.03901 0.04322 0.04431 0.04612 0.05329 0.05505 0.05809 0.06391 0.06627 0.06939 0.07138 0.07510 0.07745 0.08008 0.08776 0.09203 0.09400 0.09732 0.09928 0.10264 0.10324 0.10638 0.11188 0.11551 0.11860 0.12060 0.12350 0.12456 0.12800 0.13030 0.13227 0.13498 0.13683 0.14066 0.14248 0.14298 0.14538 0.14666 0.14855 0.14919 0.15088 0.15576 0.15889 0.16406 0.16539 0.16629 0.17000 0.17376 0.17434 0.17937 0.18203 0.18532 0.18626 0.19052 0.19128 0.19337 0.19420 0.19641 0.20056 0.20205 0.20483 0.20627 0.20874 0.21055 0.21383 0.21487 0.21946 0.21987 0.22155 0.22209 0.22343 0.22962 0.23004 0.23185 0.23384 0.23922 0.24023 0.24103 0.24334 0.24594 0.24883 0.25017 0.25594 0.25715 0.25958 0.26273 0.26505 0.26795 0.27149 0.27442 0.27514 0.27650 0.28081 0.28412 0.28679 0.28748 0.28967 0.29015 0.29381 0.29829 0.30176 0.30336 0.30419 0.30749 0.30938 0.31482 0.32198 0.32586 0.32795 0.32902 0.33226 0.33900 0.34014 0.34222 0.34339 0.34796 0.34885 0.35385 0.35477 0.35878 0.36194 0.36318 0.37042 0.37770 0.37916 0.38288 0.38852 0.39248 0.39578 0.40154 0.40645 0.40766 0.41407 0.42687 0.42905 0.43198 0.43835 0.44335 0.45713 0.46228 0.46442 0.46917 0.48122 0.48548 0.49878 0.50743 0.51077 0.51575 0.52014 0.52508 0.52799 0.53352 0.53671 0.53756 0.53870 0.54667 0.54781 0.55395 0.55556 0.56037 0.56108 0.56357 0.57164 0.57449 0.58022 0.58660 0.58966 0.59753 0.60161 0.61009 0.61498 0.61702 0.62165 0.62661 0.63271 0.63809 0.64151 0.64688 0.64842 0.65662 0.66007 0.66462 0.67037 0.67599 0.68288 0.68733 0.68930 0.69367 0.69550 0.69774 0.70036 0.70881 0.71108 0.71392 0.71613 0.72032 0.72357 0.72647 0.72761 0.73562 0.74065 0.74298 0.74592 0.75144 0.75579 0.76250 0.76924 0.77256 0.77865 0.78415 0.78889 0.79404 0.80101 0.80675 0.80917 0.81568 0.82334 0.82718 0.82971 0.83882 0.84043 0.84600 0.84796 0.84945 0.85652 0.86254 0.86389 0.87126 0.87648 0.88375 0.89066 0.89594 0.90045 0.90737 0.91076 0.91661 0.92214 0.93039 0.93757 0.94330 0.95167 0.95825 0.96067 0.97635 0.97824 0.98854 0.99701 1.00788 1.02193 1.02696 1.02728 1.03151 1.03566 1.04606 1.04827 1.05286 1.05600 1.05918 1.06806 1.07538 1.07723 1.08360 1.08699 1.09860 1.10554 1.11303 1.11717 1.12483 1.13416 1.13898 1.14172 1.16489 1.16706 1.16951 1.18506 1.18912 1.20332 1.21828 1.22618 1.24007 1.24816 1.25950 1.26542 1.27587 1.29297 1.30078 1.30865 1.32048 1.32246 1.33284 1.34302 1.35043 1.35647 1.37053 1.37841 1.41114 1.41724 1.42994 1.44172 1.44723 1.46512 1.47159 1.47929 1.49557 1.49943 1.50559 1.50848 1.51226 1.51920 1.52506 1.53249 1.54286 1.55226 1.55404 1.56180 1.56501 1.56863 1.57136 1.57295 1.57511 1.57675 1.58475 1.59241 1.59388 1.59960 1.60561 1.62277 1.64136 1.64658 1.65143 1.65566 1.66217 1.66537 1.66690 1.67272 1.68975 1.69711 1.70424 1.71150 1.72508 1.72908 1.73738 1.74056 1.74282 1.75562 1.75679 1.76938 1.77745 1.78364 1.79264 1.79566 1.79685 1.79880 1.81796 1.82879 1.83963 1.84412 1.85547 1.86102 1.88014 1.88191 1.89649 1.89999 1.90588 1.91349 1.91690 1.92486 1.92898 1.93205 1.93959 1.94576 1.95029 1.95722 1.96150 1.96680 1.97350 1.98227 1.98797 1.98938 1.99465 2.00170 2.00528 2.01408 2.01773 2.02436 2.02993 2.03346 2.04382 2.05948 2.06990 2.07198 2.07961 2.08681 2.09278 2.10025 2.10404 2.11051 2.13230 2.13602 2.15043 2.16612 2.19067 2.20731 2.24216 2.24640 2.27082 2.28162 2.29684 2.30890 2.32999 2.34095 2.35497 2.36160 2.37296 2.39136 2.39639 2.40253 2.40572 2.41635 2.42437 2.43170 2.43551 2.45253 2.47153 2.48070 2.48394 2.48805 2.50900 2.56279 2.56818 2.58223 2.60210 2.62574 2.62805 2.63721 2.64651 2.65148 2.65391 2.66022 2.67127 2.68440 2.68801 2.69341 2.69939 2.70594 2.71163 2.71573 2.71671 2.72091 2.72495 2.73462 2.74641 2.74955 2.75383 2.75955 2.76273 2.76326 2.77052 2.78448 2.79817 2.80255 2.80659 2.81231 2.81488 2.82703 2.83208 2.83604 2.84463 2.85131 2.85731 2.86347 2.87486 2.87847 2.88282 2.89046 2.89661 2.90220 2.90929 2.92063 2.92228 2.93568 2.93781 2.94664 2.95497 2.96062 2.97640 2.98573 3.00473 3.02465 3.03597 3.06708 3.08326 3.09339 3.09870 3.10371 3.11591 3.13140 3.14009 3.15523 3.16691 3.17769 3.20086 3.21981 3.23020 3.25253 3.26557 3.31878 3.33672 3.34396 3.35715 3.36525 3.37873 3.38201 3.39976 3.41361 3.44298 3.45634 3.45980 3.50260 3.50761 3.51412 3.53361 3.53681 3.54515 3.55628 3.56719 3.59987 3.61220 3.63855 3.65696 3.67426 3.67594 3.72999 3.78381 3.81483 3.81774 3.86353 3.86976 3.97878 3.98028 3.98263 4.00790 4.01578 4.03095 4.03358 4.05537 4.08855 4.11840 4.13537 4.14497 4.15506 4.16174 4.17466 4.20318 4.21684 4.24108 4.26039 4.34503 4.37681 4.84441 4.85521 4.86206 4.86750 4.92374 5.09921 5.12801 5.13927 5.14479 5.18836 5.24102 5.35637 5.45129 5.49143 5.76414 5.83772 5.92467 5.96242 23.59483 23.62015 23.63552 23.80533 23.90672 23.92748 23.95293 23.96422 23.96675 23.97073 23.97681 23.98113 23.98711 24.07690 24.09026 24.09560 24.11104 24.12359 24.12475 24.20485 24.21364 24.22460 35.52026 35.59290 49.93273 49.98688 50.01996 50.08770 1-A. -1.5182 -0.0779 0.1941 1.5325 -146.1215 -147.6060 -179.8777 -2.4733 -5.6900 0.0655 11.7469 10.2624 -22.0093 -2.4733 -5.6900 0.0655 31.8554 -4.6724 -16.1938 23.3366 18.7915 52.9676 -45.4680 -12.1987 0.5400 -17.8989 -10170.9928 -4131.7648 -1195.8243 75.3323 -230.6840 -59.1135 -4.6290 5.7083 32.1308 -2456.4463 -2310.0147 -979.0151 36.4091 -10.1580 -5.0727 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; 0.000000 3.520807 0.000000 2.266942 4.584388 0.000000 6.351374 6.423777 7.620242 0.000000 2.232703 2.328841 2.323536 6.788034 0.000000 3.550733 2.914668 2.883475 7.467325 1.379892 0.000000 1.458437 2.463196 3.466174 5.691163 2.309200 3.644816 0.000000 2.441592 3.095681 4.266115 4.168743 3.208240 4.356476 1.527056 0.000000 2.352764 1.200193 3.467595 6.221308 1.387683 2.444482 1.538801 2.461428 0.000000 2.418611 3.086862 4.532873 6.531570 3.496124 4.804456 1.520303 2.566545 2.550847 0.000000 1.351789 3.484201 1.193744 6.879784 1.408774 2.454940 2.313340 3.229200 2.323123 3.460620 0.000000 3.745482 3.141137 5.537099 3.659415 4.086175 5.061438 2.525968 1.398937 3.037587 3.138645 4.447007 0.000000 2.749741 4.263543 4.163422 3.673560 3.761412 4.796579 2.549356 1.397805 3.473043 3.678446 3.415153 2.413368 0.000000 4.858396 4.309382 6.485750 2.388278 5.172677 6.001429 3.810880 2.422312 4.271228 4.472234 5.495232 1.391075 2.789069 0.000000 4.137510 5.185252 5.357755 2.407727 4.918570 5.778130 3.825696 2.420251 4.590693 4.866772 4.696944 2.786181 1.391526 2.417841 0.000000 5.005421 5.190400 6.397041 1.382598 5.507930 6.299588 4.309213 2.786222 4.902506 5.183393 5.585306 2.403321 2.405584 1.390994 1.391545 0.000000 4.263531 3.752785 3.383540 7.023811 2.383509 1.422641 4.386184 4.662813 3.342390 5.747423 3.170353 5.300614 4.792735 5.952209 5.502323 6.024156 0.000000 5.535292 4.957245 4.261416 8.122516 3.636676 2.422060 5.758746 6.052682 4.659507 7.084740 4.329471 6.654067 6.101783 7.224669 6.716919 7.234489 1.398524 0.000000 4.191240 3.873563 3.757028 5.727689 2.813110 2.465133 4.176321 3.986833 3.434915 5.654343 3.401044 4.538221 3.889467 4.935650 4.343477 4.827549 1.396797 2.417326 0.000000 6.984986 6.941681 7.899071 1.383680 7.127461 7.584508 6.444203 4.978673 6.753106 7.479131 7.279965 4.579997 4.349397 3.384945 3.062779 2.373497 6.893630 7.815923 5.521065 0.000000 6.506551 5.990892 5.235633 8.126351 4.785594 3.700821 6.719133 6.749749 5.724246 8.130752 5.369032 7.269708 6.598262 7.603365 6.961203 7.438085 2.415292 1.390401 2.786119 7.589705 0.000000 5.415541 5.138829 4.833879 5.748662 4.198155 3.729714 5.433462 4.993952 4.788345 6.928917 4.656065 5.414655 4.641490 5.490559 4.726150 5.143100 2.413372 2.781243 1.393696 5.210924 2.403941 0.000000 6.465744 6.078195 5.487855 7.044583 5.021562 4.221256 6.592520 6.310718 5.788411 8.073646 5.514196 6.744384 5.981873 6.847122 6.094057 6.515727 2.799689 2.419683 2.422574 6.376620 1.395458 1.392320 0.000000 8.233159 8.335469 9.084313 2.360957 8.464478 8.897244 7.763239 6.280233 8.131776 8.763915 8.541511 5.894756 5.541916 4.642975 4.183226 3.595841 8.128291 8.962426 6.737344 1.394056 8.597014 6.256746 7.302232 0.000000 6.713231 6.365166 7.330638 2.440235 6.452226 6.688215 6.210737 4.894137 6.224736 7.413706 6.759786 4.583757 4.350935 3.622834 3.320194 2.837673 5.845539 6.643351 4.474958 1.395334 6.321793 3.997316 5.089859 2.424375 0.000000 9.112674 9.115731 9.691425 3.641675 9.125599 9.376917 8.721181 7.298179 8.931690 9.835917 9.250129 6.969535 6.519384 5.773977 5.218890 4.757954 8.435505 9.081056 7.052968 2.405654 8.509144 6.311586 7.146034 1.391644 2.790859 0.000000 7.776564 7.371830 8.081646 3.693988 7.311672 7.329591 7.383755 6.155283 7.251915 8.664230 7.647052 5.911630 5.549585 4.998010 4.560932 4.218984 6.281677 6.818824 4.953255 2.405908 6.217829 4.099100 4.879106 2.787245 1.394468 2.408132 0.000000 8.916468 8.698297 9.241845 4.168033 8.619303 8.677871 8.562288 7.252642 8.551700 9.799447 8.856084 6.985314 6.529913 5.929394 5.382364 5.016063 7.611060 8.100147 6.275602 2.786299 7.404129 5.358104 6.028138 2.420642 2.422867 1.395810 1.393246 0.000000 2.696493 4.108988 4.913152 6.475124 4.295305 5.656404 2.147327 2.804259 3.486611 1.090686 3.959317 3.444240 3.651903 4.618870 4.776042 5.176180 6.506106 7.859441 6.286546 7.525965 8.842903 7.488988 8.690371 8.726569 7.640601 9.872276 8.934568 9.972591 0.000000 2.635944 3.319981 4.426942 7.571449 3.516706 4.747112 2.157140 3.500320 2.789591 1.091601 3.463180 4.141498 4.540770 5.505052 5.811805 6.208590 5.881742 7.131288 6.038790 8.463753 8.293961 7.382775 8.413971 9.765983 8.306588 10.794551 9.504972 10.684956 1.780136 0.000000 3.365696 2.908058 5.425599 6.438185 4.019955 5.210908 2.149241 2.828973 2.804544 1.090147 4.287555 2.881921 4.126777 4.193513 5.130711 5.152914 6.125856 7.461744 5.983833 7.435069 8.481352 7.225433 8.388789 8.728288 7.396418 9.827175 8.675822 9.812119 1.777629 1.773216 0.000000 4.129962 2.704187 5.960553 4.526129 4.223197 5.151360 2.718452 2.155800 2.953586 2.965234 4.797499 1.082660 3.397027 2.140882 3.868227 3.381151 5.577841 6.906996 5.015764 5.433564 7.631137 5.987005 7.241420 6.744615 5.369814 7.797676 6.654814 7.767716 3.465015 3.874569 2.368640 0.000000 2.357189 4.718560 3.458846 4.546802 3.672846 4.711578 2.758177 2.153757 3.727833 3.905227 2.949209 3.396367 1.081738 3.870792 2.142834 3.384174 4.728946 5.971342 3.969271 5.095159 6.497511 4.733154 5.973083 6.196468 5.034231 7.083908 6.099847 7.048235 3.801949 4.593793 4.587729 4.295626 0.000000 3.934252 3.643394 2.833280 8.419534 1.980007 1.012147 4.258807 5.158968 3.148149 5.273890 2.718293 5.953176 5.568318 6.952551 6.624283 7.233119 2.056461 2.580540 3.291537 8.536321 3.952218 4.446879 4.720627 9.831709 7.636558 10.286755 8.229212 9.562736 6.111760 5.020919 5.765061 6.007481 5.341373 0.000000 5.841220 4.798322 7.476882 2.600955 5.992506 6.730167 4.683828 3.410589 4.993197 5.185229 6.453785 2.161217 3.871686 1.082838 3.391389 2.139571 6.664802 7.881870 5.662395 3.547235 8.209756 6.126365 7.429882 4.687047 3.857631 5.803485 5.163803 6.011704 5.368245 6.202948 4.710325 2.483752 4.953365 7.701452 0.000000 4.757261 6.142727 5.681662 2.637092 5.602166 6.377503 4.703067 3.406644 5.471465 5.775698 5.221174 3.869198 2.157865 3.393494 1.083123 2.143298 5.946140 7.048049 4.732610 2.992876 7.138000 4.877991 6.169412 3.853445 3.350828 4.792681 4.400304 5.029218 5.601213 6.675744 6.131660 4.951105 2.481056 7.173393 4.274820 0.000000 5.946192 5.297136 4.509184 9.111730 3.963700 2.631958 6.228043 6.738111 5.043637 7.433203 4.669428 7.369903 6.896170 8.062289 7.629449 8.163318 2.155039 1.085187 3.400487 8.861578 2.150947 3.866430 3.402471 10.029441 7.701704 10.163373 7.891538 9.176319 8.258215 7.323841 7.825461 7.519127 6.710712 2.396214 8.713165 7.998506 0.000000 3.495186 3.341364 3.636990 4.895650 2.522940 2.718342 3.307946 2.929714 2.815127 4.796648 3.022706 3.501706 2.876127 3.938868 3.391584 3.870876 2.161255 3.404354 1.082129 4.897588 3.868147 2.143852 3.396329 6.189269 4.041513 6.700884 4.802976 6.112338 5.365308 5.314508 5.105478 4.065549 3.109266 3.643392 4.740326 3.925983 4.303204 0.000000 7.491055 6.940330 6.059891 9.123194 5.733990 4.561484 7.751022 7.828349 6.713750 9.139195 6.299480 8.342214 7.667346 8.663066 8.012351 8.486536 3.393472 2.140853 3.870170 8.511082 1.084085 3.389855 2.154332 9.450549 7.210938 9.249315 6.960660 8.071380 9.868199 9.245452 9.493581 8.676792 7.530064 4.648869 9.240232 8.142383 2.465834 4.952222 0.000000 5.731165 5.589744 5.426132 4.933277 4.840991 4.602057 5.670669 4.944700 5.243883 7.154100 5.184495 5.251935 4.414758 5.066057 4.187747 4.524130 3.390095 3.865190 2.140798 4.252719 3.390600 1.084041 2.151962 5.221351 3.031608 5.236494 3.074059 4.307408 7.606660 7.742089 7.409085 5.943250 4.612827 5.386116 5.663985 4.216886 4.950372 2.451412 4.292314 0.000000 7.425095 7.072679 6.442788 7.345586 6.080910 5.304573 7.552285 7.143435 6.809045 9.046014 6.516594 7.512664 6.703179 7.452759 6.632401 7.003866 3.883053 3.401480 3.404718 6.498115 2.156370 2.154543 1.083381 7.253064 5.189573 6.892673 4.687438 5.674985 9.620967 9.434262 9.343556 8.057649 6.708783 5.785494 7.976101 6.579782 4.297165 4.289365 2.487400 2.486555 0.000000 8.627640 8.897361 9.646425 2.550166 9.085344 9.638310 8.143014 6.627207 8.671541 9.012157 9.078157 6.209258 5.882981 4.916808 4.495502 3.878193 8.963013 9.870222 7.581031 2.139246 9.572306 7.202640 8.298533 1.083098 3.395824 2.166010 3.870105 3.411373 8.857978 10.050924 8.959339 7.056924 6.540704 10.570333 4.909146 4.139058 10.926595 6.941619 10.451480 6.186304 8.285001 0.000000 5.882098 5.308721 6.516164 2.700643 5.452145 5.677344 5.315414 4.097739 5.200626 6.554351 5.874225 3.806543 3.744528 3.072959 2.992879 2.565109 4.907652 5.791747 3.570509 2.154234 5.627305 3.313905 4.519079 3.404228 1.082385 3.873179 2.156639 3.404803 6.886863 7.401338 6.529987 4.537059 4.469033 6.645687 3.423337 3.303932 6.822352 3.080658 6.578836 2.523656 4.819688 4.284832 0.000000 10.097656 10.189340 10.664261 4.502429 10.180739 10.436249 9.735934 8.295609 9.994773 10.822587 10.258604 7.965393 7.471921 6.734844 6.140592 5.698633 9.473439 10.079296 8.093459 3.386056 9.447469 7.302734 8.067303 2.142948 3.874969 1.084122 3.392896 2.154122 10.806768 11.795608 10.816063 8.796942 8.000148 11.334988 6.719299 5.630751 11.163253 7.758990 10.141172 6.222902 7.730018 2.491906 4.957279 0.000000 7.860041 7.248429 7.924643 4.576745 7.107761 6.925696 7.510266 6.435416 7.171726 8.859316 7.550036 6.255637 5.915743 5.516317 5.124647 4.883219 5.767881 6.124441 4.537717 3.385844 5.398424 3.507335 4.065219 3.871609 2.143338 3.393908 1.084415 2.152625 9.239032 9.616440 8.887444 6.921030 6.397601 7.784742 5.708954 5.031857 7.178920 4.615360 6.062767 2.592074 3.778098 4.954402 2.473203 4.293608 0.000000 9.779110 9.515104 9.926889 5.251271 9.360288 9.295589 9.479500 8.222265 9.382220 10.761418 9.617896 7.987793 7.486731 6.969039 6.385530 6.078290 8.134066 8.459279 6.858071 3.869726 7.610987 5.788172 6.232646 3.402143 3.404213 2.155899 2.153597 1.083428 10.967584 11.614465 10.789425 8.747258 7.942546 10.141829 7.035474 5.985906 9.518408 6.837427 8.154726 4.787991 5.700657 4.309901 4.299877 2.485656 2.484149 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.8141,-1.605,1.3183;2.6216,-.9727,-2.1399;3.5371,.3786,2.1441;-3.3768,-1.9485,-.0584;3.1009,.0798,-.1185;3.2914,1.3765,-.55;2.312,-2.085,.036;.786,-2.1338,.0659;2.7021,-.9632,-.9424;2.9851,-3.4106,-.2816;3.1777,-.3057,1.2344;.0899,-2.5066,-1.0889;.0696,-1.7203,1.1927;-1.2993,-2.4459,-1.1264;-1.32,-1.6569,1.1589;-1.9963,-2.0044,-.0065;2.2212,2.2857,-.3216;2.4937,3.6565,-.3711;.9124,1.8472,-.1074;-3.9825,-.7051,-.0183;1.4651,4.5764,-.2005;-.1088,2.7793,.0681;.1568,4.1453,.0224;-5.3141,-.677,.3932;-3.3331,.4657,-.4114;-5.9977,.535,.4158;-4.0303,1.673,-.3801;-5.3603,1.7162,.0326;2.6883,-4.1569,.4564;4.0707,-3.2974,-.2642;2.6842,-3.748,-1.2736;.6326,-2.7977,-1.9794;.5949,-1.4393,2.0956;4.1979,1.7219,-.2614;-1.8493,-2.7107,-2.0208;-1.8823,-1.3231,2.0224;3.5088,3.9995,-.543;.6808,.7909,-.0692;1.6901,5.6362,-.2366;-1.1174,2.4261,.2504;-.6408,4.865,.1625;-5.7905,-1.6037,.6886;-2.3037,.4331,-.7442;-7.0325,.556,.7381;-3.5272,2.5818,-.6916;-5.8957,2.6579,.0537; 0.2485959 0.1365625 0.0985981 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= 738 738 738 738 738 MxSgAt= 46 MxSgA2= 46. 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= 724 RedAO= T EigKep= 1.07D-06 NBF= 724 NBsUse= 720 1.00D-06 EigRej= 9.94D-07 NBFU= 720 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= 748 748 748 748 748 MxSgAt= 46 MxSgA2= 46. 1 -5.97287430e-01 -3.06325164e-02 7.63661172e-02 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 8 8 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 -0.005222230 -0.009424746 0.012416160 0.001227100 0.001080840 -0.013411890 0.005140780 0.005813492 0.012950997 -0.005390318 -0.003685499 -0.010794863 0.000092157 -0.001990556 -0.001437409 0.010076442 0.003669328 -0.003875570 -0.004176948 -0.004280107 -0.009082892 -0.000407311 -0.000332046 -0.000069296 -0.002250941 -0.003651089 0.001171489 0.001324782 -0.005166228 -0.001104552 0.000394974 0.000066563 0.000900646 0.002842921 -0.001326527 -0.005088663 0.001146928 0.000154252 0.005625056 -0.000979476 -0.000662645 -0.004953206 -0.002404791 0.000695983 0.005143663 0.007017908 -0.000962183 0.000515801 -0.000711323 0.003793053 0.000127947 0.005430628 0.000259458 0.000765368 -0.004541615 -0.003949464 -0.001047237 -0.003845209 0.003205322 0.005230490 0.003832101 0.003956146 0.000734162 -0.005632305 0.000896041 -0.000516378 -0.002207740 0.004728784 0.000394149 -0.002523343 -0.004421445 -0.001798394 0.004140509 0.003349563 -0.002072231 -0.004786576 -0.002281075 0.001925336 0.001763020 0.004894873 0.001652604 -0.003249003 0.003337503 0.003134982 -0.001138763 0.000133630 0.001651913 0.001673116 0.000858236 0.000967713 -0.000291511 0.001065301 -0.001792912 0.001576792 -0.000059822 0.000069897 0.002096728 -0.000474797 0.000276409 0.001985029 -0.000585680 0.001565623 -0.001480410 0.000491823 -0.000236504 -0.001021230 0.000460509 -0.000771911 0.001120596 -0.000793875 0.000068702 0.000671062 -0.001591192 0.000033799 0.000959933 0.001251126 0.000286702 -0.001632569 0.000316045 -0.000093801 -0.000596417 0.001442436 0.000123066 0.000943231 -0.000995537 -0.000871738 0.000800644 -0.001196946 -0.000615302 -0.001385475 -0.000559520 0.000492296 0.000498917 0.001581714 0.000450478 -0.000880791 0.000888955 0.000959302 0.013411890 0.003571683 (Enter /usr/local/gaussian/gaussian16/g16/l716.exe) Closed 1 1 1 -1259.96096689908 -1259.96096884056 -0.000001941479 -1259.96096882777 0.000000012798 -1259.96096887115 -0.000000043382 -1259.96096887216 -0.000000001013 -1259.96096887262 -0.000000000461 -1259.96096887287 -0.000000000248 -1259.96096887271 0.000000000161 -1259.96096887278 -0.000000000068 -1259.96096887 9 1.254851028749e+03 -8.021169096125e+03 2.963567860781e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 4246732800 LenX= 4245575618 LenY= 4245009362 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) PT758331.500S Wed May 4 00:59:00 2022 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H 0.021812 -0.231943 -0.275126 0.042287 -0.173395 0.109444 0.033358 0.875243 0.121128 -0.384537 0.260688 -0.181926 -0.134275 -0.236415 -0.205661 -0.932265 -0.884351 -0.286101 1.108419 -0.477821 -0.294416 -0.414551 -0.102967 -0.090194 0.444882 -0.114737 -0.123814 -0.123702 0.176447 0.160961 0.180812 0.148332 0.143953 0.246546 0.131733 0.154065 0.101980 0.175818 0.125888 0.127453 0.121441 0.126661 0.140095 0.130739 0.130406 0.127607 -0.00000 -19.20058 -19.17455 -19.14041 -19.13796 -14.42297 -14.38848 -10.35692 -10.31709 -10.28796 -10.25428 -10.24965 -10.23303 -10.21352 -10.20159 -10.20103 -10.19719 -10.19697 -10.19614 -10.18855 -10.18764 -10.18689 -10.18604 -10.18590 -10.18567 -10.18417 -10.18326 -10.18069 -10.17844 -1.16299 -1.09531 -1.09253 -1.07156 -1.04112 -0.90374 -0.89175 -0.86817 -0.85456 -0.83051 -0.77950 -0.77447 -0.76321 -0.76182 -0.75577 -0.74338 -0.70129 -0.66934 -0.66134 -0.64450 -0.63855 -0.63184 -0.62481 -0.60643 -0.60024 -0.57252 -0.56469 -0.55958 -0.53776 -0.51402 -0.50943 -0.50136 -0.49649 -0.48858 -0.48770 -0.47442 -0.47070 -0.45976 -0.45681 -0.45551 -0.45441 -0.44983 -0.44257 -0.44111 -0.43728 -0.43299 -0.43114 -0.42058 -0.41183 -0.40738 -0.40108 -0.39619 -0.38083 -0.37883 -0.37699 -0.37463 -0.36099 -0.35526 -0.34368 -0.34150 -0.33856 -0.32916 -0.31466 -0.29782 -0.28343 -0.27031 -0.26790 -0.26686 -0.24103 -0.23596 -0.05389 -0.04328 -0.02848 -0.02262 -0.02240 -0.01515 -0.01356 -0.00740 0.00001 0.00299 0.01314 0.01592 0.01824 0.01984 0.02429 0.03243 0.03379 0.03634 0.03937 0.04284 0.04443 0.05117 0.05280 0.05553 0.05984 0.06266 0.06529 0.06846 0.07430 0.07630 0.08067 0.08832 0.09059 0.09338 0.09584 0.09750 0.09999 0.10345 0.10490 0.10921 0.11158 0.11547 0.11898 0.12112 0.12322 0.12491 0.12664 0.12872 0.13319 0.13516 0.13593 0.13845 0.14087 0.14292 0.14523 0.14723 0.14988 0.15568 0.15805 0.16012 0.16077 0.16823 0.16917 0.17210 0.17423 0.17897 0.17986 0.18283 0.18484 0.18855 0.18962 0.19170 0.19286 0.19493 0.19788 0.19845 0.20052 0.20484 0.20600 0.20971 0.21118 0.21349 0.21400 0.21732 0.21760 0.22213 0.22382 0.22500 0.22789 0.23009 0.23432 0.23772 0.23989 0.24151 0.24363 0.24468 0.24656 0.25339 0.25385 0.25567 0.25769 0.26044 0.26162 0.26529 0.26574 0.26969 0.27235 0.27632 0.27726 0.27823 0.28098 0.28563 0.28748 0.28881 0.29309 0.29568 0.29836 0.30174 0.30440 0.30849 0.31137 0.31642 0.31886 0.32100 0.32229 0.32578 0.32907 0.33109 0.33389 0.33642 0.33874 0.34121 0.34350 0.34963 0.35285 0.35527 0.35778 0.36325 0.36792 0.36963 0.37241 0.37888 0.38339 0.38464 0.39238 0.39609 0.39843 0.40382 0.40585 0.41206 0.41416 0.42068 0.43119 0.43646 0.44824 0.45722 0.46278 0.46491 0.47235 0.47948 0.48516 0.49277 0.49719 0.50425 0.51177 0.51851 0.52291 0.52386 0.52845 0.53387 0.53820 0.54044 0.54452 0.54705 0.55019 0.55364 0.56517 0.56613 0.56960 0.57202 0.58031 0.58194 0.58847 0.59956 0.60124 0.60520 0.61106 0.61426 0.61487 0.61958 0.62476 0.62840 0.63681 0.63968 0.64243 0.64461 0.64988 0.65661 0.66115 0.66724 0.67081 0.67979 0.68225 0.68706 0.69297 0.69533 0.69742 0.70279 0.70564 0.70690 0.71118 0.71580 0.71852 0.72226 0.72675 0.73087 0.73339 0.73503 0.74472 0.74595 0.74671 0.75436 0.76089 0.76758 0.77008 0.77378 0.78132 0.79493 0.80037 0.80285 0.81007 0.81378 0.81713 0.82247 0.82934 0.83519 0.83937 0.84125 0.84626 0.84921 0.85703 0.86349 0.86832 0.87294 0.87526 0.88435 0.88791 0.88972 0.90009 0.90410 0.91088 0.91247 0.92470 0.92926 0.93096 0.93366 0.94161 0.94776 0.96073 0.96594 0.97597 0.98812 0.99029 0.99537 1.00784 1.01259 1.01502 1.02700 1.03010 1.03834 1.04240 1.04978 1.05710 1.05897 1.06415 1.07105 1.07442 1.08693 1.09174 1.09699 1.09960 1.11273 1.11399 1.12291 1.12872 1.13698 1.14146 1.14823 1.15897 1.16106 1.17243 1.18621 1.19249 1.20265 1.21277 1.21737 1.22122 1.23963 1.25874 1.26309 1.27517 1.28323 1.29808 1.30807 1.31524 1.32539 1.33685 1.34960 1.35374 1.36134 1.38352 1.39118 1.40030 1.41212 1.42130 1.42459 1.45871 1.46309 1.46603 1.47766 1.49344 1.49758 1.50125 1.50922 1.51373 1.52129 1.52271 1.53140 1.53395 1.54536 1.54724 1.55273 1.56117 1.56362 1.56591 1.56899 1.56939 1.57697 1.57985 1.58334 1.59170 1.59657 1.60207 1.61130 1.62832 1.63769 1.64271 1.64772 1.65032 1.66015 1.66744 1.67468 1.68666 1.69219 1.69873 1.70736 1.71067 1.72804 1.73570 1.74168 1.74287 1.74537 1.75626 1.77023 1.77692 1.77959 1.78904 1.79486 1.79633 1.79955 1.81567 1.81934 1.83103 1.84043 1.84835 1.85480 1.87408 1.87892 1.88510 1.88871 1.90012 1.91111 1.91238 1.92060 1.92394 1.93133 1.93884 1.94564 1.94602 1.95598 1.95743 1.96375 1.97092 1.97560 1.98154 1.98361 1.98707 1.99326 1.99448 2.00472 2.00812 2.02408 2.03312 2.03938 2.05163 2.05756 2.06807 2.06893 2.07818 2.07977 2.08450 2.09436 2.10953 2.11696 2.12010 2.13668 2.14184 2.14873 2.18462 2.19115 2.23384 2.24439 2.26067 2.27225 2.28294 2.29542 2.31830 2.33115 2.33946 2.34196 2.35263 2.38530 2.39174 2.39725 2.40053 2.41496 2.42553 2.42745 2.43180 2.43641 2.47207 2.47742 2.48436 2.50086 2.50896 2.55019 2.55088 2.57073 2.59902 2.61718 2.62113 2.62533 2.63294 2.63612 2.64715 2.65745 2.66398 2.67281 2.68036 2.68465 2.69146 2.69387 2.70115 2.70396 2.71013 2.71964 2.72480 2.72844 2.73852 2.74948 2.75370 2.75881 2.76400 2.76570 2.77159 2.78328 2.78725 2.79112 2.79942 2.80899 2.81629 2.82169 2.82977 2.83717 2.83861 2.85440 2.86035 2.86371 2.87791 2.88086 2.88559 2.89178 2.89244 2.90223 2.90706 2.91137 2.92723 2.93182 2.93483 2.94432 2.94923 2.95666 2.97385 2.97744 2.99455 3.00678 3.02778 3.04384 3.06637 3.07665 3.08479 3.09448 3.10260 3.10738 3.12259 3.14622 3.15545 3.16895 3.19088 3.20517 3.21782 3.22119 3.23375 3.30887 3.31365 3.32977 3.34011 3.35705 3.36431 3.37549 3.38155 3.39243 3.42090 3.43288 3.44894 3.48100 3.49586 3.50820 3.51745 3.52200 3.53114 3.53746 3.55811 3.57750 3.59288 3.62000 3.63134 3.65008 3.67374 3.68788 3.77175 3.80470 3.81173 3.84333 3.85239 3.96066 3.97311 3.98785 3.99421 4.01322 4.02539 4.02868 4.04568 4.07849 4.11180 4.11693 4.14927 4.15376 4.16103 4.16718 4.18819 4.20036 4.22025 4.23811 4.32119 4.34302 4.82722 4.83716 4.84071 4.85037 4.88892 5.09241 5.12573 5.13914 5.15973 5.17433 5.21949 5.32014 5.44317 5.44805 5.72642 5.82232 5.87576 5.92623 23.60032 23.61214 23.62978 23.77411 23.87239 23.90474 23.93259 23.94933 23.95320 23.95825 23.96301 23.97166 23.97290 24.05269 24.06734 24.06935 24.09028 24.09518 24.09663 24.17594 24.18982 24.19425 35.49288 35.57104 49.92603 49.98335 50.00418 50.07365 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H 0.022696 -0.220437 -0.260271 0.024511 -0.180777 0.094942 0.173116 0.389615 0.129669 -0.328842 0.201627 -0.221823 -0.225286 -0.245257 -0.077277 -0.466565 -0.208426 -0.517717 0.393202 -0.645760 -0.040259 -0.067939 -0.419509 -0.340698 0.843169 -0.188699 -0.180558 -0.174550 0.178628 0.165057 0.180852 0.147708 0.152052 0.246171 0.140199 0.140166 0.107626 0.212467 0.128616 0.130344 0.125003 0.128883 0.161272 0.131231 0.136041 0.125785 -0.00000 -1.87438554e-01 -6.68253465e-02 -1.26652952e-01 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] -0.4764 -0.1699 -0.3219 0.5995 -152.0542 -148.2751 -178.9767 -4.9895 -7.1772 0.1092 7.7145 11.4935 -19.2080 -4.9895 -7.1772 0.1092 19.7893 28.3913 5.1417 44.1729 23.1855 0.6175 -35.2655 -27.0211 -15.4775 -4.8032 -8221.0925 -4541.4708 -989.9502 -14.6319 -252.4052 -47.7975 25.7519 6.6643 9.1250 -2115.3355 -1884.1801 -1009.6432 -34.9767 -19.3892 16.0172 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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 -1259.9609689 7.948E-9 5.433E-6 4.8895894,8.2430117,-13.1326012,-1.9290236,-4.8300577,6.1609115 C01 [X(C22H18N2O4)] -0.1904705 0.0015246 -0.1391348 0.000011604 0.000006670 0.000012371 -0.000000441 -0.000001738 0.000004114 -0.000000488 0.000004727 0.000004188 -0.000006281 0.000002166 0.000004632 0.000006908 0.000008146 -0.000007277 -0.000007612 -0.000000494 0.000007328 -0.000005306 -0.000013085 -0.000013325 -0.000004750 0.000000105 -0.000016277 -0.000002167 0.000010955 -0.000006114 0.000001407 0.000004936 0.000004927 -0.000007590 -0.000012742 0.000000749 0.000016776 -0.000003722 0.000008037 -0.000012135 0.000004873 0.000011150 -0.000014032 0.000004071 0.000010507 0.000014611 -0.000005472 0.000004604 0.000001240 0.000000393 -0.000021871 0.000004506 -0.000003017 -0.000000488 0.000001048 -0.000000553 -0.000001549 -0.000000773 0.000000049 -0.000001061 0.000009458 -0.000010857 0.000004492 -0.000003115 -0.000000379 0.000001229 -0.000000019 0.000000357 -0.000000166 0.000000985 -0.000001236 -0.000000505 0.000000174 -0.000001266 -0.000002461 -0.000002572 0.000009358 -0.000000857 0.000004348 0.000003411 -0.000001412 0.000001746 -0.000003514 -0.000000332 -0.000004476 -0.000000372 0.000000108 0.000000375 -0.000000175 0.000000022 0.000000080 0.000000749 -0.000000765 -0.000001170 -0.000000447 -0.000000551 -0.000001080 0.000000398 -0.000000458 -0.000000391 -0.000000657 -0.000001046 -0.000001202 -0.000000807 -0.000004557 0.000000887 -0.000000512 -0.000000206 -0.000002966 0.000002018 -0.000000386 -0.000000204 0.000000262 0.000000337 0.000001812 -0.000000740 0.000000570 -0.000000320 -0.000000255 -0.000000683 0.000001332 0.000000455 -0.000001165 -0.000000022 0.000000095 0.000000548 -0.000000601 0.000000089 0.000001292 0.000000216 0.000001009 0.000001752 0.000000112 -0.000002451 0.000000382 -0.000000942 -0.000000353 0.000000010 0.000001027 -0.000000448 0.000000161 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; Gaussian 16 GINC-BELVIS8 APULGAR Optimization famoxadone CONF42 gas EM64L-G16RevC.01 132 C1[X(C22H18N2O4)] 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; Optimization famoxadone CONF42 gas 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 16 16 16 16 14 14 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.9949146 15.9949146 15.9949146 15.9949146 14.0030740 14.0030740 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5.6000000 5.6000000 5.6000000 5.6000000 4.5500000 4.5500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 (Enter /usr/local/gaussian/gaussian16/g16/l101.exe) Structure from the checkpoint file: "/home/apulgar/almacen/pesticidas/gaussian_results/C3/famoxadone/gas/CONF42/opt-b3lyp-pople.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 1 1 2 3 4 4 5 5 5 6 6 7 7 7 8 8 10 10 10 12 12 13 13 14 14 15 15 17 17 18 18 19 19 20 20 21 21 22 22 23 24 24 25 25 26 26 27 27 28 7 11 9 11 16 20 6 9 11 17 34 8 9 10 12 13 29 30 31 14 32 15 33 16 35 16 36 18 19 21 37 22 38 24 25 23 39 23 40 41 26 42 27 43 28 44 28 45 46 1.4584 1.3518 1.2002 1.1937 1.3826 1.3837 1.3799 1.3877 1.4088 1.4226 1.0121 1.5271 1.5388 1.5203 1.3989 1.3978 1.0907 1.0916 1.0901 1.3911 1.0827 1.3915 1.0817 1.391 1.0828 1.3915 1.0831 1.3985 1.3968 1.3904 1.0852 1.3937 1.0821 1.3941 1.3953 1.3955 1.0841 1.3923 1.084 1.0834 1.3916 1.0831 1.3945 1.0824 1.3958 1.0841 1.3932 1.0844 1.0834 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 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 7 16 6 6 9 5 5 17 1 1 1 8 8 9 7 7 12 2 2 5 7 7 7 29 29 30 1 1 3 8 8 14 8 8 15 12 12 16 13 13 16 4 4 14 6 6 18 17 17 21 17 17 22 4 4 24 18 18 23 19 19 23 21 21 22 20 20 26 20 20 27 24 24 28 25 25 28 26 26 27 1 4 5 5 5 6 6 6 7 7 7 7 7 7 8 8 8 9 9 9 10 10 10 10 10 10 11 11 11 12 12 12 13 13 13 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25 26 26 26 27 27 27 28 28 28 11 20 9 11 11 17 34 34 8 9 10 9 10 10 12 13 13 5 7 7 29 30 31 30 31 31 3 5 5 14 32 32 15 33 33 16 35 35 16 36 36 14 15 15 18 19 19 21 37 37 22 38 38 24 25 25 23 39 39 23 40 40 22 41 41 26 42 42 27 43 43 28 44 44 28 45 45 27 46 46 110.7531 118.1879 124.0755 123.3606 112.347 116.5205 110.7992 114.2037 109.7128 103.4047 108.5575 106.806 114.7503 112.992 119.3107 121.2309 119.2923 128.1447 127.7032 104.0781 109.5564 110.2782 109.739 109.3173 109.1974 108.731 125.7734 107.9371 126.2568 120.5019 120.0814 119.3448 120.3804 120.0568 119.5608 119.5058 121.2581 119.2156 119.6201 120.8749 119.4956 118.8753 120.4347 120.6699 118.3017 121.93 119.7142 120.0007 119.8482 120.151 119.7323 120.8233 119.4433 116.4136 122.826 120.7181 120.5831 119.2889 120.127 120.8122 119.012 120.1735 119.1548 120.3748 120.4698 119.4402 118.9101 121.6497 119.1728 120.2615 120.5636 120.5478 119.3775 120.0744 120.7138 119.1552 120.1281 119.4059 120.2966 120.2974 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 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 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 11 11 11 7 7 20 20 16 16 9 9 11 11 6 6 11 11 6 6 9 9 5 5 34 34 1 1 9 9 10 10 1 1 8 8 10 10 1 1 1 8 8 8 9 9 9 7 7 13 13 7 7 12 12 8 8 32 32 8 8 33 33 12 12 35 35 13 13 36 36 6 6 19 19 6 6 18 18 17 17 37 37 17 17 38 38 4 4 25 25 4 4 24 24 18 18 39 39 19 19 40 40 20 20 42 42 20 20 43 43 24 24 44 44 25 25 45 45 1 1 1 1 1 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 17 17 17 17 17 17 17 17 18 18 18 18 19 19 19 19 20 20 20 20 20 20 20 20 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 26 26 26 26 27 27 27 27 7 7 7 11 11 16 16 20 20 6 6 6 6 9 9 9 9 11 11 11 11 17 17 17 17 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 10 10 10 12 12 12 12 13 13 13 13 14 14 14 14 15 15 15 15 16 16 16 16 16 16 16 16 18 18 18 18 19 19 19 19 21 21 21 21 22 22 22 22 24 24 24 24 25 25 25 25 23 23 23 23 23 23 23 23 26 26 26 26 27 27 27 27 28 28 28 28 28 28 28 28 8 9 10 3 5 14 15 24 25 17 34 17 34 2 7 2 7 1 3 1 3 18 19 18 19 12 13 12 13 12 13 2 5 2 5 2 5 29 30 31 29 30 31 29 30 31 14 32 14 32 15 33 15 33 16 35 16 35 16 36 16 36 4 15 4 15 4 14 4 14 21 37 21 37 22 38 22 38 23 39 23 39 23 40 23 40 26 42 26 42 27 43 27 43 22 41 22 41 21 41 21 41 28 44 28 44 28 45 28 45 27 46 27 46 26 46 26 46 -101.8837 11.7647 132.0013 174.5579 -7.4222 -112.8562 68.7667 -158.2845 24.0698 98.475 -128.7053 -75.7608 57.0588 10.0931 -166.9398 -175.1106 7.8565 174.112 -7.8802 -0.7276 177.2801 161.5713 -21.1126 30.3162 -152.3677 176.9474 1.6645 65.5112 -109.7717 -60.5425 124.1746 171.5089 -11.4404 -72.7566 104.2941 54.3458 -128.6035 64.6405 -55.7236 -175.4785 -58.491 -178.8552 61.39 178.7255 58.3614 -61.3935 -174.2868 2.6105 1.0885 177.9858 174.132 -5.356 -1.1518 179.3603 0.3056 178.6432 -176.6144 1.7231 -0.1779 -179.057 179.3126 0.4334 179.9634 -1.6634 1.5916 179.9649 179.9491 1.6012 -1.1562 -179.5041 177.7094 -2.2742 0.332 -179.6516 -177.8924 2.5065 -0.6133 179.7857 0.076 179.7266 -179.9404 -0.2898 0.4942 -178.9651 -179.8992 0.6415 -177.9593 2.0759 -0.2606 179.7747 177.9667 -1.5011 0.4195 -179.0483 -0.1989 179.5236 -179.8466 -0.124 -0.0874 -179.8097 179.3656 -0.3567 -0.0874 -179.8657 179.8763 0.0981 -0.2342 -179.6211 179.232 -0.1549 0.2691 -179.8725 -179.9541 -0.0958 -0.1064 -179.9648 179.2746 -0.5838 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|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. 0.00013 0.00227 0.00273 0.00365 0.00534 0.00889 0.01116 0.01321 0.01570 0.01610 0.01649 0.01691 0.01705 0.01745 0.01760 0.01793 0.01810 0.01838 0.02058 0.02158 0.02203 0.02238 0.02268 0.02273 0.02311 0.02494 0.02515 0.02547 0.02647 0.02758 0.02824 0.02859 0.02886 0.02910 0.02940 0.03065 0.03338 0.04279 0.04490 0.04777 0.05668 0.06070 0.06851 0.10489 0.10804 0.10861 0.11063 0.11257 0.11308 0.11509 0.11717 0.11907 0.11924 0.12115 0.12216 0.12243 0.12460 0.12580 0.12695 0.12899 0.13329 0.14956 0.15503 0.15870 0.17691 0.17793 0.18134 0.18589 0.18608 0.18924 0.19109 0.19336 0.19363 0.19599 0.20168 0.21087 0.21468 0.21862 0.22182 0.22897 0.23715 0.25375 0.27361 0.27450 0.28670 0.29671 0.30786 0.31095 0.32168 0.32677 0.33704 0.33917 0.34110 0.34211 0.34743 0.34980 0.35309 0.35399 0.35555 0.35608 0.35717 0.35748 0.35788 0.35894 0.35989 0.36039 0.36164 0.36280 0.36452 0.36967 0.38331 0.39067 0.40380 0.41105 0.41308 0.42977 0.43362 0.44255 0.45477 0.46149 0.46590 0.46638 0.46681 0.46706 0.46913 0.49315 0.50548 0.51231 0.53555 0.56123 0.87613 0.91103 Angle between quadratic step and forces= 78.56 degrees. 1 2 0.00074117 0.00000042 0.00000010 0.00000000 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 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 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 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 2.75605 2.55451 2.26804 2.25585 2.61273 2.61478 2.60762 2.62234 2.66220 2.68840 1.91268 2.88572 2.90791 2.87296 2.64361 2.64147 2.06110 2.06283 2.06008 2.62875 2.04593 2.62960 2.04419 2.62860 2.04627 2.62964 2.04681 2.64283 2.63956 2.62748 2.05071 2.63370 2.04493 2.63438 2.63680 2.63703 2.04862 2.63110 2.04854 2.04729 2.62983 2.04676 2.63516 2.04541 2.63770 2.04869 2.63285 2.04925 2.04738 1.93301 2.06277 2.16553 2.15305 1.96083 2.03367 1.93381 1.99323 1.91485 1.80475 1.89469 1.86412 2.00277 1.97208 2.08236 2.11588 2.08204 2.23655 2.22884 1.81651 1.91212 1.92472 1.91531 1.90795 1.90585 1.89771 2.19516 1.88386 2.20360 2.10316 2.09582 2.08296 2.10103 2.09539 2.08673 2.08577 2.11635 2.08070 2.08776 2.10967 2.08559 2.07476 2.10198 2.10609 2.06475 2.12808 2.08941 2.09441 2.09175 2.09703 2.08972 2.10876 2.08468 2.03180 2.14372 2.10693 2.10457 2.08198 2.09661 2.10857 2.07715 2.09742 2.07964 2.10094 2.10259 2.08462 2.07537 2.12319 2.07996 2.09896 2.10423 2.10396 2.08353 2.09569 2.10685 2.07965 2.09663 2.08403 2.09957 2.09959 -1.77821 0.20533 2.30386 3.04661 -0.12954 -1.96971 1.20020 -2.76259 0.42010 1.71871 -2.24633 -1.32228 0.99586 0.17616 -2.91365 -3.05626 0.13712 3.03883 -0.13754 -0.01270 3.09412 2.81995 -0.36848 0.52912 -2.65932 3.08831 0.02905 1.14339 -1.91588 -1.05667 2.16726 2.99340 -0.19967 -1.26984 1.82028 0.94851 -2.24456 1.12819 -0.97256 -3.06268 -1.02086 -3.12161 1.07146 3.11935 1.01860 -1.07152 -3.04188 0.04556 0.01900 3.10644 3.03918 -0.09348 -0.02010 3.13043 0.00533 3.11791 -3.08250 0.03007 -0.00311 -3.12513 3.12959 0.00756 3.14095 -0.02903 0.02778 3.14098 3.14070 0.02795 -0.02018 -3.13294 3.10161 -0.03969 0.00580 -3.13551 -3.10481 0.04375 -0.01070 3.13785 0.00133 3.13682 -3.14055 -0.00506 0.00863 -3.12353 -3.13983 0.01120 -3.10598 0.03623 -0.00455 3.13766 3.10611 -0.02620 0.00732 -3.12498 -0.00347 3.13328 -3.13892 -0.00216 -0.00153 -3.13827 3.13052 -0.00623 -0.00153 -3.13925 3.13943 0.00171 -0.00409 -3.13498 3.12819 -0.00270 0.00470 -3.13937 -3.14079 -0.00167 -0.00186 -3.14098 3.12893 -0.01019 0.00001 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00001 -0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00001 -0.00001 -0.00001 0.00001 0.00000 -0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00000 -0.00001 -0.00000 0.00001 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00001 -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 -0.00001 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 0.00001 -0.00001 0.00000 0.00000 -0.00001 0.00000 -0.00000 0.00000 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 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 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 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00006 -0.00003 -0.00001 0.00000 0.00001 -0.00003 -0.00003 -0.00000 0.00004 -0.00005 -0.00001 0.00000 0.00003 -0.00003 -0.00004 0.00004 0.00000 -0.00000 0.00000 0.00004 -0.00000 -0.00004 -0.00000 -0.00005 -0.00000 0.00002 0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00001 -0.00000 0.00001 0.00001 -0.00001 -0.00000 0.00000 -0.00001 0.00000 -0.00001 0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 -0.00002 -0.00001 -0.00001 0.00000 0.00004 0.00006 0.00008 -0.00001 -0.00001 -0.00002 -0.00004 0.00004 0.00003 -0.00001 -0.00001 0.00001 0.00000 -0.00002 0.00001 -0.00001 0.00001 0.00001 0.00000 -0.00001 0.00000 0.00001 0.00001 -0.00002 -0.00000 0.00002 -0.00002 -0.00002 -0.00000 0.00003 -0.00001 -0.00002 0.00003 0.00001 0.00004 -0.00005 0.00008 -0.00009 0.00001 0.00004 -0.00004 0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00002 0.00002 -0.00006 0.00008 -0.00003 0.00001 -0.00001 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00002 0.00000 -0.00002 0.00001 0.00002 -0.00003 0.00001 -0.00003 0.00002 0.00001 -0.00001 -0.00000 -0.00002 0.00002 -0.00000 0.00009 0.00004 0.00006 -0.00016 -0.00014 0.00085 0.00084 -0.00074 -0.00073 0.00011 0.00033 0.00038 0.00060 0.00012 0.00009 -0.00013 -0.00016 -0.00005 -0.00003 0.00019 0.00022 -0.00026 -0.00027 -0.00048 -0.00049 -0.00006 0.00003 -0.00002 0.00007 -0.00005 0.00003 0.00004 0.00007 0.00002 0.00004 0.00006 0.00009 -0.00021 -0.00021 -0.00022 -0.00022 -0.00022 -0.00023 -0.00022 -0.00023 -0.00024 0.00012 0.00010 0.00004 0.00001 -0.00013 -0.00011 -0.00004 -0.00002 0.00001 -0.00002 0.00004 0.00001 0.00000 0.00004 -0.00002 0.00002 -0.00007 -0.00005 -0.00004 -0.00003 0.00006 0.00005 0.00002 0.00001 -0.00001 -0.00004 0.00000 -0.00003 0.00001 0.00003 -0.00000 0.00002 0.00000 -0.00000 0.00004 0.00003 -0.00000 -0.00002 -0.00002 -0.00004 0.00001 0.00002 0.00000 0.00002 -0.00002 -0.00004 -0.00001 -0.00003 -0.00000 -0.00002 0.00000 -0.00001 0.00000 0.00002 0.00002 0.00003 0.00002 0.00001 0.00000 -0.00000 -0.00000 0.00000 0.00002 0.00002 -0.00002 -0.00001 -0.00002 -0.00000 0.00002 -0.00000 0.00001 -0.00000 0.00006 -0.00003 -0.00001 0.00000 0.00001 -0.00003 -0.00003 -0.00000 0.00004 -0.00005 -0.00001 0.00000 0.00003 -0.00003 -0.00004 0.00004 0.00000 -0.00000 0.00000 0.00004 -0.00000 -0.00004 -0.00000 -0.00005 -0.00000 0.00002 0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00001 -0.00000 0.00001 0.00001 -0.00001 -0.00000 0.00000 -0.00001 0.00000 -0.00001 0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 -0.00002 -0.00001 -0.00001 0.00000 0.00004 0.00006 0.00008 -0.00001 -0.00001 -0.00002 -0.00004 0.00004 0.00003 -0.00001 -0.00001 0.00001 0.00000 -0.00002 0.00001 -0.00001 0.00001 0.00001 0.00000 -0.00001 0.00000 0.00001 0.00001 -0.00002 -0.00000 0.00002 -0.00002 -0.00002 -0.00000 0.00003 -0.00001 -0.00002 0.00003 0.00001 0.00004 -0.00005 0.00008 -0.00009 0.00001 0.00004 -0.00004 0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00002 0.00002 -0.00006 0.00008 -0.00003 0.00001 -0.00001 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00002 0.00000 -0.00002 0.00001 0.00002 -0.00003 0.00001 -0.00003 0.00002 0.00001 -0.00001 -0.00000 -0.00002 0.00002 -0.00000 0.00009 0.00004 0.00006 -0.00016 -0.00014 0.00085 0.00084 -0.00074 -0.00073 0.00011 0.00033 0.00038 0.00060 0.00012 0.00009 -0.00013 -0.00016 -0.00005 -0.00003 0.00019 0.00022 -0.00026 -0.00027 -0.00048 -0.00049 -0.00006 0.00003 -0.00002 0.00007 -0.00005 0.00003 0.00004 0.00007 0.00002 0.00004 0.00006 0.00009 -0.00021 -0.00021 -0.00022 -0.00022 -0.00022 -0.00023 -0.00022 -0.00023 -0.00024 0.00012 0.00010 0.00004 0.00001 -0.00013 -0.00011 -0.00004 -0.00002 0.00001 -0.00002 0.00004 0.00001 0.00000 0.00004 -0.00002 0.00002 -0.00007 -0.00005 -0.00004 -0.00003 0.00006 0.00005 0.00002 0.00001 -0.00001 -0.00004 0.00000 -0.00003 0.00001 0.00003 -0.00000 0.00002 0.00000 -0.00000 0.00004 0.00003 -0.00000 -0.00002 -0.00002 -0.00004 0.00001 0.00002 0.00000 0.00002 -0.00002 -0.00004 -0.00001 -0.00003 -0.00000 -0.00002 0.00000 -0.00001 0.00000 0.00002 0.00002 0.00003 0.00002 0.00001 0.00000 -0.00000 -0.00000 0.00000 0.00002 0.00002 -0.00002 -0.00001 -0.00002 -0.00000 0.00002 -0.00000 0.00001 -0.00000 2.75611 2.55448 2.26803 2.25585 2.61274 2.61475 2.60758 2.62234 2.66224 2.68835 1.91267 2.88572 2.90795 2.87292 2.64357 2.64151 2.06110 2.06283 2.06008 2.62879 2.04593 2.62957 2.04418 2.62855 2.04627 2.62966 2.04681 2.64282 2.63957 2.62748 2.05071 2.63370 2.04493 2.63439 2.63681 2.63703 2.04862 2.63110 2.04853 2.04729 2.62982 2.04676 2.63516 2.04541 2.63769 2.04869 2.63285 2.04925 2.04738 1.93301 2.06275 2.16552 2.15304 1.96083 2.03371 1.93387 1.99331 1.91484 1.80474 1.89467 1.86408 2.00282 1.97211 2.08235 2.11587 2.08206 2.23655 2.22883 1.81652 1.91211 1.92473 1.91532 1.90795 1.90584 1.89771 2.19517 1.88386 2.20358 2.10315 2.09583 2.08294 2.10101 2.09539 2.08675 2.08576 2.11634 2.08073 2.08778 2.10971 2.08554 2.07485 2.10189 2.10610 2.06479 2.12804 2.08941 2.09440 2.09176 2.09703 2.08973 2.10874 2.08469 2.03174 2.14380 2.10690 2.10458 2.08198 2.09661 2.10857 2.07716 2.09742 2.07964 2.10094 2.10259 2.08464 2.07537 2.12317 2.07996 2.09898 2.10420 2.10397 2.08350 2.09571 2.10687 2.07964 2.09663 2.08401 2.09959 2.09958 -1.77811 0.20537 2.30391 3.04645 -0.12968 -1.96886 1.20104 -2.76332 0.41937 1.71882 -2.24600 -1.32189 0.99647 0.17627 -2.91356 -3.05638 0.13697 3.03877 -0.13756 -0.01251 3.09434 2.81969 -0.36875 0.52864 -2.65981 3.08826 0.02908 1.14337 -1.91581 -1.05672 2.16729 2.99344 -0.19960 -1.26983 1.82032 0.94858 -2.24446 1.12798 -0.97277 -3.06290 -1.02108 -3.12183 1.07122 3.11913 1.01837 -1.07176 -3.04176 0.04566 0.01904 3.10645 3.03904 -0.09359 -0.02015 3.13041 0.00534 3.11790 -3.08247 0.03009 -0.00310 -3.12509 3.12957 0.00758 3.14089 -0.02908 0.02774 3.14095 3.14077 0.02799 -0.02016 -3.13293 3.10161 -0.03974 0.00580 -3.13555 -3.10480 0.04377 -0.01071 3.13787 0.00133 3.13682 -3.14052 -0.00503 0.00862 -3.12355 -3.13985 0.01116 -3.10597 0.03625 -0.00455 3.13768 3.10609 -0.02623 0.00731 -3.12501 -0.00347 3.13326 -3.13891 -0.00218 -0.00152 -3.13825 3.13054 -0.00619 -0.00151 -3.13924 3.13943 0.00171 -0.00409 -3.13498 3.12821 -0.00268 0.00467 -3.13937 -3.14081 -0.00167 -0.00184 -3.14098 3.12895 -0.01019 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000012 0.000003 0.003598 0.000741 0.000450 0.000300 0.001800 0.001200 YES YES NO YES -9.293362e-09 6-311+G(d,p) (5D, 7F) 0.10000e-02 0.10000e-05 F 752 A 724 A 724 1152 752 98 98 2542.8422922998 46 46 46 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=131 Grimme-D3 -0.0530545778 0.000000 3.520807 0.000000 2.266942 4.584388 0.000000 6.351374 6.423777 7.620242 0.000000 2.232703 2.328841 2.323536 6.788034 0.000000 3.550733 2.914668 2.883475 7.467325 1.379892 0.000000 1.458437 2.463196 3.466174 5.691163 2.309200 3.644816 0.000000 2.441592 3.095681 4.266115 4.168743 3.208240 4.356476 1.527056 0.000000 2.352764 1.200193 3.467595 6.221308 1.387683 2.444482 1.538801 2.461428 0.000000 2.418611 3.086862 4.532873 6.531570 3.496124 4.804456 1.520303 2.566545 2.550847 0.000000 1.351789 3.484201 1.193744 6.879784 1.408774 2.454940 2.313340 3.229200 2.323123 3.460620 0.000000 3.745482 3.141137 5.537099 3.659415 4.086175 5.061438 2.525968 1.398937 3.037587 3.138645 4.447007 0.000000 2.749741 4.263543 4.163422 3.673560 3.761412 4.796579 2.549356 1.397805 3.473043 3.678446 3.415153 2.413368 0.000000 4.858396 4.309382 6.485750 2.388278 5.172677 6.001429 3.810880 2.422312 4.271228 4.472234 5.495232 1.391075 2.789069 0.000000 4.137510 5.185252 5.357755 2.407727 4.918570 5.778130 3.825696 2.420251 4.590693 4.866772 4.696944 2.786181 1.391526 2.417841 0.000000 5.005421 5.190400 6.397041 1.382598 5.507930 6.299588 4.309213 2.786222 4.902506 5.183393 5.585306 2.403321 2.405584 1.390994 1.391545 0.000000 4.263531 3.752785 3.383540 7.023811 2.383509 1.422641 4.386184 4.662813 3.342390 5.747423 3.170353 5.300614 4.792735 5.952209 5.502323 6.024156 0.000000 5.535292 4.957245 4.261416 8.122516 3.636676 2.422060 5.758746 6.052682 4.659507 7.084740 4.329471 6.654067 6.101783 7.224669 6.716919 7.234489 1.398524 0.000000 4.191240 3.873563 3.757028 5.727689 2.813110 2.465133 4.176321 3.986833 3.434915 5.654343 3.401044 4.538221 3.889467 4.935650 4.343477 4.827549 1.396797 2.417326 0.000000 6.984986 6.941681 7.899071 1.383680 7.127461 7.584508 6.444203 4.978673 6.753106 7.479131 7.279965 4.579997 4.349397 3.384945 3.062779 2.373497 6.893630 7.815923 5.521065 0.000000 6.506551 5.990892 5.235633 8.126351 4.785594 3.700821 6.719133 6.749749 5.724246 8.130752 5.369032 7.269708 6.598262 7.603365 6.961203 7.438085 2.415292 1.390401 2.786119 7.589705 0.000000 5.415541 5.138829 4.833879 5.748662 4.198155 3.729714 5.433462 4.993952 4.788345 6.928917 4.656065 5.414655 4.641490 5.490559 4.726150 5.143100 2.413372 2.781243 1.393696 5.210924 2.403941 0.000000 6.465744 6.078195 5.487855 7.044583 5.021562 4.221256 6.592520 6.310718 5.788411 8.073646 5.514196 6.744384 5.981873 6.847122 6.094057 6.515727 2.799689 2.419683 2.422574 6.376620 1.395458 1.392320 0.000000 8.233159 8.335469 9.084313 2.360957 8.464478 8.897244 7.763239 6.280233 8.131776 8.763915 8.541511 5.894756 5.541916 4.642975 4.183226 3.595841 8.128291 8.962426 6.737344 1.394056 8.597014 6.256746 7.302232 0.000000 6.713231 6.365166 7.330638 2.440235 6.452226 6.688215 6.210737 4.894137 6.224736 7.413706 6.759786 4.583757 4.350935 3.622834 3.320194 2.837673 5.845539 6.643351 4.474958 1.395334 6.321793 3.997316 5.089859 2.424375 0.000000 9.112674 9.115731 9.691425 3.641675 9.125599 9.376917 8.721181 7.298179 8.931690 9.835917 9.250129 6.969535 6.519384 5.773977 5.218890 4.757954 8.435505 9.081056 7.052968 2.405654 8.509144 6.311586 7.146034 1.391644 2.790859 0.000000 7.776564 7.371830 8.081646 3.693988 7.311672 7.329591 7.383755 6.155283 7.251915 8.664230 7.647052 5.911630 5.549585 4.998010 4.560932 4.218984 6.281677 6.818824 4.953255 2.405908 6.217829 4.099100 4.879106 2.787245 1.394468 2.408132 0.000000 8.916468 8.698297 9.241845 4.168033 8.619303 8.677871 8.562288 7.252642 8.551700 9.799447 8.856084 6.985314 6.529913 5.929394 5.382364 5.016063 7.611060 8.100147 6.275602 2.786299 7.404129 5.358104 6.028138 2.420642 2.422867 1.395810 1.393246 0.000000 2.696493 4.108988 4.913152 6.475124 4.295305 5.656404 2.147327 2.804259 3.486611 1.090686 3.959317 3.444240 3.651903 4.618870 4.776042 5.176180 6.506106 7.859441 6.286546 7.525965 8.842903 7.488988 8.690371 8.726569 7.640601 9.872276 8.934568 9.972591 0.000000 2.635944 3.319981 4.426942 7.571449 3.516706 4.747112 2.157140 3.500320 2.789591 1.091601 3.463180 4.141498 4.540770 5.505052 5.811805 6.208590 5.881742 7.131288 6.038790 8.463753 8.293961 7.382775 8.413971 9.765983 8.306588 10.794551 9.504972 10.684956 1.780136 0.000000 3.365696 2.908058 5.425599 6.438185 4.019955 5.210908 2.149241 2.828973 2.804544 1.090147 4.287555 2.881921 4.126777 4.193513 5.130711 5.152914 6.125856 7.461744 5.983833 7.435069 8.481352 7.225433 8.388789 8.728288 7.396418 9.827175 8.675822 9.812119 1.777629 1.773216 0.000000 4.129962 2.704187 5.960553 4.526129 4.223197 5.151360 2.718452 2.155800 2.953586 2.965234 4.797499 1.082660 3.397027 2.140882 3.868227 3.381151 5.577841 6.906996 5.015764 5.433564 7.631137 5.987005 7.241420 6.744615 5.369814 7.797676 6.654814 7.767716 3.465015 3.874569 2.368640 0.000000 2.357189 4.718560 3.458846 4.546802 3.672846 4.711578 2.758177 2.153757 3.727833 3.905227 2.949209 3.396367 1.081738 3.870792 2.142834 3.384174 4.728946 5.971342 3.969271 5.095159 6.497511 4.733154 5.973083 6.196468 5.034231 7.083908 6.099847 7.048235 3.801949 4.593793 4.587729 4.295626 0.000000 3.934252 3.643394 2.833280 8.419534 1.980007 1.012147 4.258807 5.158968 3.148149 5.273890 2.718293 5.953176 5.568318 6.952551 6.624283 7.233119 2.056461 2.580540 3.291537 8.536321 3.952218 4.446879 4.720627 9.831709 7.636558 10.286755 8.229212 9.562736 6.111760 5.020919 5.765061 6.007481 5.341373 0.000000 5.841220 4.798322 7.476882 2.600955 5.992506 6.730167 4.683828 3.410589 4.993197 5.185229 6.453785 2.161217 3.871686 1.082838 3.391389 2.139571 6.664802 7.881870 5.662395 3.547235 8.209756 6.126365 7.429882 4.687047 3.857631 5.803485 5.163803 6.011704 5.368245 6.202948 4.710325 2.483752 4.953365 7.701452 0.000000 4.757261 6.142727 5.681662 2.637092 5.602166 6.377503 4.703067 3.406644 5.471465 5.775698 5.221174 3.869198 2.157865 3.393494 1.083123 2.143298 5.946140 7.048049 4.732610 2.992876 7.138000 4.877991 6.169412 3.853445 3.350828 4.792681 4.400304 5.029218 5.601213 6.675744 6.131660 4.951105 2.481056 7.173393 4.274820 0.000000 5.946192 5.297136 4.509184 9.111730 3.963700 2.631958 6.228043 6.738111 5.043637 7.433203 4.669428 7.369903 6.896170 8.062289 7.629449 8.163318 2.155039 1.085187 3.400487 8.861578 2.150947 3.866430 3.402471 10.029441 7.701704 10.163373 7.891538 9.176319 8.258215 7.323841 7.825461 7.519127 6.710712 2.396214 8.713165 7.998506 0.000000 3.495186 3.341364 3.636990 4.895650 2.522940 2.718342 3.307946 2.929714 2.815127 4.796648 3.022706 3.501706 2.876127 3.938868 3.391584 3.870876 2.161255 3.404354 1.082129 4.897588 3.868147 2.143852 3.396329 6.189269 4.041513 6.700884 4.802976 6.112338 5.365308 5.314508 5.105478 4.065549 3.109266 3.643392 4.740326 3.925983 4.303204 0.000000 7.491055 6.940330 6.059891 9.123194 5.733990 4.561484 7.751022 7.828349 6.713750 9.139195 6.299480 8.342214 7.667346 8.663066 8.012351 8.486536 3.393472 2.140853 3.870170 8.511082 1.084085 3.389855 2.154332 9.450549 7.210938 9.249315 6.960660 8.071380 9.868199 9.245452 9.493581 8.676792 7.530064 4.648869 9.240232 8.142383 2.465834 4.952222 0.000000 5.731165 5.589744 5.426132 4.933277 4.840991 4.602057 5.670669 4.944700 5.243883 7.154100 5.184495 5.251935 4.414758 5.066057 4.187747 4.524130 3.390095 3.865190 2.140798 4.252719 3.390600 1.084041 2.151962 5.221351 3.031608 5.236494 3.074059 4.307408 7.606660 7.742089 7.409085 5.943250 4.612827 5.386116 5.663985 4.216886 4.950372 2.451412 4.292314 0.000000 7.425095 7.072679 6.442788 7.345586 6.080910 5.304573 7.552285 7.143435 6.809045 9.046014 6.516594 7.512664 6.703179 7.452759 6.632401 7.003866 3.883053 3.401480 3.404718 6.498115 2.156370 2.154543 1.083381 7.253064 5.189573 6.892673 4.687438 5.674985 9.620967 9.434262 9.343556 8.057649 6.708783 5.785494 7.976101 6.579782 4.297165 4.289365 2.487400 2.486555 0.000000 8.627640 8.897361 9.646425 2.550166 9.085344 9.638310 8.143014 6.627207 8.671541 9.012157 9.078157 6.209258 5.882981 4.916808 4.495502 3.878193 8.963013 9.870222 7.581031 2.139246 9.572306 7.202640 8.298533 1.083098 3.395824 2.166010 3.870105 3.411373 8.857978 10.050924 8.959339 7.056924 6.540704 10.570333 4.909146 4.139058 10.926595 6.941619 10.451480 6.186304 8.285001 0.000000 5.882098 5.308721 6.516164 2.700643 5.452145 5.677344 5.315414 4.097739 5.200626 6.554351 5.874225 3.806543 3.744528 3.072959 2.992879 2.565109 4.907652 5.791747 3.570509 2.154234 5.627305 3.313905 4.519079 3.404228 1.082385 3.873179 2.156639 3.404803 6.886863 7.401338 6.529987 4.537059 4.469033 6.645687 3.423337 3.303932 6.822352 3.080658 6.578836 2.523656 4.819688 4.284832 0.000000 10.097656 10.189340 10.664261 4.502429 10.180739 10.436249 9.735934 8.295609 9.994773 10.822587 10.258604 7.965393 7.471921 6.734844 6.140592 5.698633 9.473439 10.079296 8.093459 3.386056 9.447469 7.302734 8.067303 2.142948 3.874969 1.084122 3.392896 2.154122 10.806768 11.795608 10.816063 8.796942 8.000148 11.334988 6.719299 5.630751 11.163253 7.758990 10.141172 6.222902 7.730018 2.491906 4.957279 0.000000 7.860041 7.248429 7.924643 4.576745 7.107761 6.925696 7.510266 6.435416 7.171726 8.859316 7.550036 6.255637 5.915743 5.516317 5.124647 4.883219 5.767881 6.124441 4.537717 3.385844 5.398424 3.507335 4.065219 3.871609 2.143338 3.393908 1.084415 2.152625 9.239032 9.616440 8.887444 6.921030 6.397601 7.784742 5.708954 5.031857 7.178920 4.615360 6.062767 2.592074 3.778098 4.954402 2.473203 4.293608 0.000000 9.779110 9.515104 9.926889 5.251271 9.360288 9.295589 9.479500 8.222265 9.382220 10.761418 9.617896 7.987793 7.486731 6.969039 6.385530 6.078290 8.134066 8.459279 6.858071 3.869726 7.610987 5.788172 6.232646 3.402143 3.404213 2.155899 2.153597 1.083428 10.967584 11.614465 10.789425 8.747258 7.942546 10.141829 7.035474 5.985906 9.518408 6.837427 8.154726 4.787991 5.700657 4.309901 4.299877 2.485656 2.484149 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.8141,-1.605,1.3183;2.6216,-.9727,-2.1399;3.5371,.3786,2.1441;-3.3768,-1.9485,-.0584;3.1009,.0798,-.1185;3.2914,1.3765,-.55;2.312,-2.085,.036;.786,-2.1338,.0659;2.7021,-.9632,-.9424;2.9851,-3.4106,-.2816;3.1777,-.3057,1.2344;.0899,-2.5066,-1.0889;.0696,-1.7203,1.1927;-1.2993,-2.4459,-1.1264;-1.32,-1.6569,1.1589;-1.9963,-2.0044,-.0065;2.2212,2.2857,-.3216;2.4937,3.6565,-.3711;.9124,1.8472,-.1074;-3.9825,-.7051,-.0183;1.4651,4.5764,-.2005;-.1088,2.7793,.0681;.1568,4.1453,.0224;-5.3141,-.677,.3932;-3.3331,.4657,-.4114;-5.9977,.535,.4158;-4.0303,1.673,-.3801;-5.3603,1.7162,.0326;2.6883,-4.1569,.4564;4.0707,-3.2974,-.2642;2.6842,-3.748,-1.2736;.6326,-2.7977,-1.9794;.5949,-1.4393,2.0956;4.1979,1.7219,-.2614;-1.8493,-2.7107,-2.0208;-1.8823,-1.3231,2.0224;3.5088,3.9995,-.543;.6808,.7909,-.0692;1.6901,5.6362,-.2366;-1.1174,2.4261,.2504;-.6408,4.865,.1625;-5.7905,-1.6037,.6886;-2.3037,.4331,-.7442;-7.0325,.556,.7381;-3.5272,2.5818,-.6916;-5.8957,2.6579,.0537; 0.2485959 0.1365625 0.0985981 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= 724 RedAO= T EigKep= 1.07D-06 NBF= 724 NBsUse= 720 1.00D-06 EigRej= 9.94D-07 NBFU= 720 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= 748 748 748 748 748 MxSgAt= 46 MxSgA2= 46. 1 Closed 1 1 1 -1259.96096887295 -1259.96096887 1 1.254851029789e+03 -8.021169098510e+03 2.963567862125e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 4246732800 LenX= 4245575618 LenY= 4245009362 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= 46. Will process 47 centers per pass. Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 Minotr: Closed shell wavefunction. IDoAtm=1111111111111111111111111111111111111111111111 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. 14220 words used for storage of precomputed grid. Two-electron integrals replicated using symmetry. MDV= 4246732800 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= 760000000 NMat= 138 IRICut= 345 DoRegI=T DoRafI=T ISym2E= 2 IDoP0=3 IntGTp=3. FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 0 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 138 NMatS0= 138 NMatT0= 0 NMatD0= 138 NMtDS0= 0 NMtDT0= 0 Integrals replicated using symmetry in FoFCou. Raff kept on since 74.36% of shell-pairs survive, threshold= 0.20 IRatSp=74. There are 141 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 138 vectors produced by pass 0 Test12= 6.10D-14 1.00D-09 XBig12= 3.65D+02 5.62D+00. AX will form 138 AO Fock derivatives at one time. 138 vectors produced by pass 1 Test12= 6.10D-14 1.00D-09 XBig12= 8.05D+01 1.93D+00. 138 vectors produced by pass 2 Test12= 6.10D-14 1.00D-09 XBig12= 6.46D-01 6.35D-02. 138 vectors produced by pass 3 Test12= 6.10D-14 1.00D-09 XBig12= 3.16D-03 3.81D-03. 138 vectors produced by pass 4 Test12= 6.10D-14 1.00D-09 XBig12= 9.86D-06 1.99D-04. 133 vectors produced by pass 5 Test12= 6.10D-14 1.00D-09 XBig12= 1.82D-08 7.37D-06. 54 vectors produced by pass 6 Test12= 6.10D-14 1.00D-09 XBig12= 2.56D-11 3.34D-07. 3 vectors produced by pass 7 Test12= 6.10D-14 1.00D-09 XBig12= 3.42D-14 1.43D-08. InvSVY: IOpt=1 It= 1 EMax= 4.62D-14 Solved reduced A of dimension 880 with 141 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 276.27 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 335.658 -14.643 293.239 -11.235 9.171 199.909 486.809 -11.074 442.169 -23.595 23.541 362.290 (Enter /usr/local/gaussian/gaussian16/g16/l716.exe) PT162321.800S Wed May 4 03:27:55 2022 -19.20058 -19.17455 -19.14041 -19.13796 -14.42297 -14.38848 -10.35692 -10.31709 -10.28796 -10.25428 -10.24965 -10.23303 -10.21352 -10.20159 -10.20103 -10.19719 -10.19697 -10.19614 -10.18855 -10.18764 -10.18689 -10.18604 -10.18590 -10.18567 -10.18417 -10.18326 -10.18069 -10.17844 -1.16299 -1.09531 -1.09253 -1.07156 -1.04112 -0.90374 -0.89175 -0.86817 -0.85456 -0.83051 -0.77950 -0.77447 -0.76321 -0.76182 -0.75577 -0.74338 -0.70129 -0.66934 -0.66134 -0.64450 -0.63855 -0.63184 -0.62481 -0.60643 -0.60024 -0.57252 -0.56469 -0.55958 -0.53776 -0.51402 -0.50943 -0.50136 -0.49649 -0.48858 -0.48770 -0.47442 -0.47070 -0.45976 -0.45681 -0.45551 -0.45441 -0.44983 -0.44257 -0.44111 -0.43728 -0.43299 -0.43114 -0.42058 -0.41183 -0.40738 -0.40108 -0.39619 -0.38083 -0.37883 -0.37700 -0.37463 -0.36099 -0.35526 -0.34368 -0.34150 -0.33856 -0.32916 -0.31466 -0.29782 -0.28343 -0.27031 -0.26790 -0.26686 -0.24103 -0.23596 -0.05389 -0.04328 -0.02848 -0.02262 -0.02240 -0.01515 -0.01356 -0.00740 0.00001 0.00299 0.01314 0.01592 0.01824 0.01984 0.02429 0.03243 0.03379 0.03634 0.03937 0.04284 0.04443 0.05117 0.05280 0.05553 0.05984 0.06266 0.06529 0.06846 0.07430 0.07630 0.08067 0.08832 0.09059 0.09338 0.09584 0.09750 0.09999 0.10345 0.10490 0.10921 0.11158 0.11547 0.11898 0.12112 0.12322 0.12491 0.12664 0.12872 0.13319 0.13516 0.13593 0.13845 0.14087 0.14292 0.14523 0.14723 0.14988 0.15568 0.15805 0.16012 0.16077 0.16823 0.16917 0.17210 0.17423 0.17897 0.17986 0.18283 0.18484 0.18855 0.18962 0.19170 0.19286 0.19493 0.19788 0.19845 0.20052 0.20484 0.20600 0.20971 0.21118 0.21349 0.21400 0.21732 0.21760 0.22213 0.22382 0.22500 0.22789 0.23009 0.23432 0.23772 0.23989 0.24151 0.24363 0.24468 0.24656 0.25339 0.25385 0.25567 0.25769 0.26044 0.26162 0.26529 0.26574 0.26969 0.27235 0.27632 0.27726 0.27823 0.28098 0.28563 0.28748 0.28881 0.29309 0.29568 0.29836 0.30174 0.30440 0.30849 0.31137 0.31642 0.31886 0.32100 0.32229 0.32578 0.32907 0.33109 0.33389 0.33642 0.33874 0.34121 0.34350 0.34963 0.35285 0.35527 0.35778 0.36325 0.36792 0.36963 0.37241 0.37888 0.38339 0.38464 0.39238 0.39609 0.39843 0.40382 0.40585 0.41206 0.41416 0.42068 0.43119 0.43646 0.44824 0.45722 0.46278 0.46491 0.47235 0.47948 0.48516 0.49277 0.49719 0.50425 0.51177 0.51851 0.52291 0.52386 0.52845 0.53387 0.53820 0.54044 0.54452 0.54705 0.55019 0.55364 0.56517 0.56613 0.56960 0.57202 0.58031 0.58194 0.58847 0.59956 0.60124 0.60520 0.61106 0.61426 0.61487 0.61958 0.62476 0.62840 0.63681 0.63968 0.64243 0.64461 0.64988 0.65661 0.66115 0.66724 0.67081 0.67979 0.68225 0.68706 0.69297 0.69533 0.69742 0.70279 0.70564 0.70690 0.71118 0.71580 0.71852 0.72226 0.72675 0.73087 0.73339 0.73503 0.74472 0.74595 0.74671 0.75436 0.76089 0.76758 0.77008 0.77378 0.78132 0.79493 0.80037 0.80285 0.81007 0.81378 0.81713 0.82247 0.82934 0.83519 0.83937 0.84125 0.84626 0.84921 0.85703 0.86349 0.86832 0.87294 0.87526 0.88435 0.88791 0.88972 0.90009 0.90410 0.91088 0.91247 0.92470 0.92926 0.93096 0.93366 0.94161 0.94776 0.96073 0.96594 0.97597 0.98812 0.99029 0.99537 1.00784 1.01259 1.01502 1.02700 1.03010 1.03834 1.04240 1.04978 1.05710 1.05897 1.06415 1.07105 1.07442 1.08693 1.09174 1.09699 1.09960 1.11273 1.11399 1.12291 1.12872 1.13698 1.14146 1.14823 1.15897 1.16106 1.17243 1.18621 1.19249 1.20265 1.21277 1.21737 1.22122 1.23963 1.25874 1.26309 1.27517 1.28323 1.29808 1.30807 1.31524 1.32539 1.33685 1.34960 1.35374 1.36134 1.38352 1.39118 1.40030 1.41212 1.42130 1.42459 1.45871 1.46309 1.46603 1.47766 1.49344 1.49758 1.50125 1.50922 1.51373 1.52129 1.52271 1.53140 1.53395 1.54536 1.54724 1.55273 1.56117 1.56362 1.56591 1.56899 1.56939 1.57697 1.57985 1.58334 1.59170 1.59657 1.60207 1.61130 1.62832 1.63769 1.64271 1.64772 1.65032 1.66015 1.66744 1.67468 1.68666 1.69219 1.69873 1.70736 1.71067 1.72804 1.73570 1.74168 1.74287 1.74537 1.75626 1.77023 1.77692 1.77959 1.78904 1.79486 1.79633 1.79955 1.81567 1.81934 1.83103 1.84043 1.84835 1.85480 1.87408 1.87892 1.88510 1.88871 1.90012 1.91111 1.91238 1.92060 1.92394 1.93133 1.93884 1.94564 1.94602 1.95598 1.95743 1.96375 1.97092 1.97560 1.98154 1.98361 1.98707 1.99326 1.99448 2.00472 2.00812 2.02408 2.03312 2.03938 2.05163 2.05756 2.06807 2.06893 2.07818 2.07977 2.08450 2.09436 2.10953 2.11696 2.12010 2.13668 2.14184 2.14873 2.18462 2.19115 2.23384 2.24439 2.26067 2.27225 2.28294 2.29542 2.31830 2.33115 2.33946 2.34196 2.35263 2.38530 2.39174 2.39725 2.40053 2.41496 2.42553 2.42745 2.43180 2.43641 2.47207 2.47742 2.48436 2.50086 2.50896 2.55019 2.55088 2.57073 2.59902 2.61718 2.62113 2.62533 2.63294 2.63612 2.64715 2.65745 2.66398 2.67281 2.68036 2.68465 2.69146 2.69387 2.70115 2.70396 2.71013 2.71964 2.72480 2.72844 2.73852 2.74948 2.75370 2.75881 2.76400 2.76570 2.77159 2.78328 2.78725 2.79112 2.79942 2.80899 2.81629 2.82169 2.82977 2.83717 2.83861 2.85440 2.86035 2.86371 2.87791 2.88086 2.88559 2.89178 2.89244 2.90223 2.90706 2.91137 2.92723 2.93182 2.93483 2.94432 2.94923 2.95666 2.97385 2.97744 2.99455 3.00678 3.02778 3.04384 3.06637 3.07665 3.08479 3.09448 3.10260 3.10738 3.12259 3.14622 3.15545 3.16895 3.19088 3.20517 3.21782 3.22119 3.23375 3.30887 3.31365 3.32977 3.34011 3.35705 3.36431 3.37549 3.38155 3.39243 3.42090 3.43288 3.44894 3.48100 3.49586 3.50820 3.51745 3.52200 3.53114 3.53746 3.55811 3.57750 3.59288 3.62000 3.63134 3.65008 3.67374 3.68788 3.77175 3.80470 3.81173 3.84333 3.85239 3.96066 3.97311 3.98785 3.99421 4.01322 4.02539 4.02868 4.04568 4.07849 4.11180 4.11693 4.14927 4.15376 4.16103 4.16718 4.18819 4.20036 4.22025 4.23811 4.32119 4.34302 4.82722 4.83716 4.84071 4.85037 4.88892 5.09241 5.12573 5.13914 5.15973 5.17433 5.21949 5.32014 5.44317 5.44805 5.72642 5.82232 5.87576 5.92623 23.60032 23.61214 23.62978 23.77411 23.87239 23.90474 23.93259 23.94933 23.95320 23.95825 23.96301 23.97166 23.97290 24.05269 24.06734 24.06935 24.09028 24.09518 24.09663 24.17594 24.18982 24.19425 35.49288 35.57104 49.92603 49.98335 50.00418 50.07365 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H 0.022696 -0.220437 -0.260271 0.024511 -0.180777 0.094942 0.173116 0.389615 0.129669 -0.328842 0.201627 -0.221823 -0.225286 -0.245257 -0.077277 -0.466566 -0.208426 -0.517717 0.393202 -0.645760 -0.040259 -0.067939 -0.419509 -0.340698 0.843169 -0.188699 -0.180558 -0.174550 0.178628 0.165057 0.180852 0.147708 0.152052 0.246171 0.140199 0.140166 0.107626 0.212467 0.128616 0.130344 0.125003 0.128883 0.161272 0.131231 0.136041 0.125785 -0.00000 Mulliken charges with hydrogens summed into heavy atoms: 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C 0.022696 -0.220437 -0.260271 0.024511 -0.180777 0.341113 0.173116 0.389615 0.129669 0.195695 0.201627 -0.074115 -0.073234 -0.105057 0.062889 -0.466566 -0.208426 -0.410091 0.605669 -0.645760 0.088357 0.062406 -0.294506 -0.211815 1.004441 -0.057468 -0.044516 -0.048766 -0.00000 -1.87437999e-01 -6.68257331e-02 -1.26653310e-01 3.35658169e+02 -1.46432173e+01 2.93238947e+02 -1.12354422e+01 9.17062239e+00 1.99908939e+02 -3.3847 -2.4294 -0.0007 -0.0004 -0.0003 0.5651 5.4228 21.9455 29.5375 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 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 4.9104 21.9400 29.5374 38.2672 46.8802 51.6913 61.8753 78.4007 98.4849 118.6603 164.2503 188.3473 198.7271 214.7373 223.6391 246.4838 262.2199 274.1698 305.4036 324.1174 332.2241 361.0634 395.7405 416.0947 417.0290 423.2495 434.2351 444.7310 481.3951 501.6226 519.9129 540.7305 560.4979 600.5266 609.3705 622.2688 632.9283 636.5559 651.0553 655.3000 701.4980 702.5358 714.2769 725.2774 734.2128 760.4243 763.2139 766.2831 768.6506 801.7492 832.7377 837.9688 842.4958 850.0567 852.9163 876.2144 889.0031 900.6361 910.7745 952.4640 973.5562 977.9247 979.8685 991.6268 995.9954 998.7881 1003.9525 1010.8143 1013.9417 1034.1637 1044.8256 1052.0165 1099.4466 1101.4646 1104.3075 1120.6375 1144.0068 1153.3346 1185.9173 1191.2770 1192.3199 1197.5672 1199.6893 1217.3143 1225.8284 1233.1687 1248.6068 1251.1748 1261.6059 1319.0559 1331.3942 1334.1300 1335.3492 1352.2346 1362.7714 1412.3380 1421.3347 1440.5921 1475.5679 1485.3396 1485.6561 1493.5279 1517.7935 1528.6817 1537.7278 1541.8459 1617.4869 1627.5334 1633.9203 1636.6411 1644.3477 1650.4208 1827.1991 1887.1131 3048.3738 3123.7461 3136.6792 3157.0410 3163.6729 3169.9629 3172.0273 3179.0156 3187.3962 3187.7257 3189.3088 3191.4864 3195.5612 3198.0112 3201.7433 3202.5417 3207.9575 3568.0518 5.9038 5.3215 4.2775 4.8403 5.7717 4.6947 4.1975 7.7826 7.4813 7.1182 6.0205 4.4004 4.7787 1.3156 2.9960 2.8267 4.8271 5.6349 3.5476 5.2268 5.2989 5.9979 6.5168 3.0012 3.5247 3.0600 4.1641 6.0783 2.5690 3.4246 3.7221 4.9764 3.3515 5.7102 4.6040 6.1872 6.6298 6.3456 6.9524 5.5933 2.2741 2.0113 4.5807 4.1371 5.5510 3.4014 3.7112 1.7538 2.9526 4.6720 1.2817 1.2471 1.2882 3.3328 3.1584 2.2746 4.2121 1.4588 1.4729 3.2003 1.3831 1.3496 1.3490 1.3509 1.2725 1.2826 3.9051 5.7927 6.0699 2.7249 2.0749 2.2084 2.3934 2.6473 1.5303 1.6392 1.5465 6.3322 1.2039 1.3179 1.2218 1.7216 2.0338 1.1564 2.3587 3.8176 3.8172 3.5892 4.3570 4.1783 2.7198 3.5599 1.7572 1.8194 1.5309 1.6702 2.9908 2.8573 1.9839 1.0691 2.1970 1.0552 2.1956 2.1408 2.3180 1.4938 6.6789 5.8705 5.7414 4.8399 5.4027 5.7882 12.7224 12.6960 1.0344 1.1036 1.1029 1.0874 1.0859 1.0876 1.0894 1.0916 1.0924 1.0890 1.0893 1.0954 1.0941 1.0956 1.0935 1.0950 1.0937 1.0762 0.0001 0.0015 0.0022 0.0042 0.0075 0.0074 0.0095 0.0282 0.0428 0.0591 0.0957 0.0920 0.1112 0.0357 0.0883 0.1012 0.1956 0.2496 0.1950 0.3235 0.3446 0.4607 0.6013 0.3061 0.3612 0.3230 0.4626 0.7083 0.3508 0.5077 0.5928 0.8573 0.6203 1.2133 1.0073 1.4116 1.5648 1.5149 1.7363 1.4151 0.6594 0.5849 1.3769 1.2822 1.7631 1.1588 1.2737 0.6067 1.0278 1.7694 0.5237 0.5160 0.5387 1.4189 1.3537 1.0289 1.9614 0.6972 0.7198 1.7106 0.7724 0.7604 0.7631 0.7827 0.7438 0.7539 2.3190 3.4871 3.6767 1.7170 1.3345 1.4401 1.7046 1.8923 1.0995 1.2129 1.1925 4.9627 0.9976 1.1020 1.0234 1.4548 1.7247 1.0096 2.0882 3.4205 3.5063 3.3104 4.0858 4.2832 2.8405 3.7332 1.8462 1.9601 1.6751 1.9629 3.5598 3.4937 2.5450 1.3897 2.8571 1.3868 2.9801 2.9475 3.2295 2.0924 10.2952 9.1619 9.0309 7.6383 8.6070 9.2893 25.0260 26.6387 5.6634 6.3448 6.3930 6.3857 6.4037 6.4391 6.4583 6.5000 6.5390 6.5201 6.5283 6.5735 6.5826 6.6020 6.6046 6.6171 6.6315 8.0726 0.3758 0.1493 0.2698 0.1404 0.4106 0.6208 0.0435 0.1841 0.8208 4.8814 1.3096 1.4405 0.3074 0.1549 2.6871 2.9135 4.2125 0.3116 18.4421 0.6974 4.2298 0.4089 3.0543 0.1334 0.7976 0.1008 0.7989 8.5037 41.3582 12.9662 22.4725 16.7717 32.9799 6.4756 14.8177 6.2457 0.4746 11.3554 2.1407 14.7876 13.7191 29.1510 8.6519 17.0743 5.6705 25.6527 51.0708 1.4610 66.8730 4.5027 0.8438 0.2215 3.1831 6.9139 27.0183 26.5148 48.3452 2.1611 5.3077 28.1778 1.1614 0.5281 0.0830 0.8684 0.0612 0.3786 6.1228 0.5400 0.2959 12.0965 9.1699 2.0611 93.6152 24.2672 18.8660 17.2828 48.4561 72.0095 11.0979 13.8682 9.4584 54.4743 61.0584 11.5141 36.5950 37.2556 74.6473 35.2447 440.0453 1.2047 1.0112 14.6343 2.9879 10.0473 3.3162 25.5380 93.0999 9.5350 21.7424 4.6997 0.2686 5.7872 163.3002 29.1334 77.6118 29.4300 5.1666 28.5700 61.7308 13.6266 76.0608 3.3126 664.1403 214.1010 11.5222 14.3414 4.7385 6.0179 1.2709 1.5318 12.0578 14.4281 20.1809 2.6675 0.3637 13.8145 8.8126 0.6869 0.1060 1.3768 0.7855 29.9711 -0.06 0.02 0.06 0.09 -0.04 0.04 -0.08 0.03 0.05 -0.00 0.01 -0.22 0.02 -0.01 0.04 0.04 -0.02 0.03 -0.01 0.00 0.04 -0.01 0.01 -0.02 0.04 -0.02 0.04 0.00 -0.01 0.10 -0.04 0.02 0.05 0.04 -0.03 -0.04 -0.06 0.05 -0.07 0.04 -0.02 -0.10 -0.05 0.06 -0.13 -0.01 0.02 -0.15 0.05 -0.00 -0.02 0.06 -0.00 -0.02 0.03 0.01 -0.07 -0.02 -0.01 -0.05 0.07 0.01 -0.07 0.04 0.03 -0.12 0.05 0.02 -0.12 0.01 -0.07 0.05 -0.07 0.04 0.01 -0.01 -0.08 0.21 -0.09 0.02 0.17 -0.06 -0.04 0.27 -0.03 0.01 0.10 0.00 -0.01 0.14 0.05 -0.02 0.09 0.08 -0.06 -0.00 -0.10 0.08 -0.05 0.04 -0.02 0.06 0.08 -0.05 -0.12 -0.09 0.09 -0.16 0.07 -0.02 0.02 0.02 0.02 -0.08 0.08 0.01 -0.07 0.02 0.04 -0.16 0.06 0.03 -0.16 0.04 -0.10 0.01 -0.10 0.08 -0.07 0.01 -0.12 0.29 -0.13 0.06 0.21 -0.07 -0.05 0.40 -0.01 -0.00 -0.01 -0.01 0.04 -0.00 0.05 -0.03 0.01 -0.03 -0.04 0.09 0.03 0.00 0.00 0.08 -0.00 0.02 -0.02 0.02 -0.02 -0.02 0.04 -0.00 -0.00 0.02 -0.00 -0.05 0.01 -0.04 0.03 -0.01 0.00 -0.04 0.10 -0.01 -0.01 -0.03 0.03 -0.04 0.08 0.01 -0.01 -0.06 0.06 -0.03 -0.00 0.06 0.10 0.03 -0.00 0.14 0.02 -0.00 0.08 0.07 -0.03 -0.07 -0.06 0.04 0.16 0.05 -0.03 0.10 0.10 -0.06 0.14 0.09 -0.06 -0.11 -0.11 -0.10 -0.06 -0.02 0.14 -0.16 -0.13 -0.15 -0.11 -0.05 0.10 -0.15 -0.10 -0.05 -0.06 0.01 -0.04 -0.05 -0.01 -0.04 -0.07 0.03 -0.04 -0.05 0.16 -0.04 0.01 -0.08 0.04 0.08 -0.03 0.04 -0.05 0.12 0.01 -0.00 -0.12 0.09 0.15 -0.01 0.02 0.05 0.07 -0.03 0.19 0.04 -0.02 0.09 0.13 -0.08 0.16 0.11 -0.08 -0.12 -0.13 -0.18 -0.02 0.02 0.26 -0.19 -0.18 -0.27 -0.10 -0.02 0.18 -0.19 -0.12 -0.09 0.00 0.04 -0.01 -0.05 -0.05 -0.02 0.04 0.05 -0.07 -0.01 -0.01 0.00 0.00 -0.00 -0.06 0.00 -0.01 -0.08 -0.01 0.01 0.01 -0.01 0.00 0.02 -0.02 -0.02 -0.02 0.00 0.00 0.04 0.02 0.03 -0.05 -0.01 -0.12 0.06 -0.01 0.13 -0.02 -0.01 -0.12 0.06 -0.00 0.13 -0.03 -0.01 0.00 0.01 0.03 0.01 -0.01 0.07 0.00 0.17 0.01 0.02 -0.12 -0.02 -0.02 -0.01 0.09 0.02 0.24 0.03 0.03 -0.05 0.07 0.03 0.13 -0.00 -0.02 0.05 -0.06 -0.03 -0.09 -0.02 -0.03 0.03 -0.07 -0.04 -0.11 -0.05 -0.04 -0.05 0.01 0.02 0.06 -0.00 0.01 0.04 0.01 -0.02 0.05 -0.01 -0.22 0.09 -0.00 0.22 -0.05 0.02 -0.02 -0.11 -0.01 -0.22 0.09 -0.00 0.23 -0.06 0.09 -0.00 0.26 -0.03 0.02 -0.26 0.13 0.01 0.38 0.01 0.04 -0.13 0.09 0.04 0.19 0.02 -0.02 0.11 -0.07 -0.03 -0.14 -0.00 -0.03 0.08 -0.10 -0.04 -0.17 -0.07 -0.04 -0.06 -0.01 0.08 0.02 0.03 -0.14 -0.02 -0.02 0.13 -0.10 0.01 0.02 -0.07 -0.01 -0.01 -0.08 -0.05 -0.03 -0.15 0.01 -0.01 0.04 0.01 -0.01 0.02 0.01 -0.07 -0.02 0.01 -0.03 0.14 -0.01 0.07 -0.06 0.03 -0.01 0.01 -0.01 -0.00 0.01 0.03 -0.00 -0.01 -0.01 0.00 -0.02 0.01 0.01 -0.03 -0.03 -0.02 -0.06 -0.02 -0.02 -0.08 -0.01 -0.01 0.07 0.01 0.02 -0.03 -0.00 -0.02 0.04 0.02 -0.01 0.19 0.02 -0.01 0.18 -0.03 -0.02 -0.16 0.04 0.05 0.13 -0.04 -0.03 -0.13 0.04 0.05 0.16 -0.00 0.01 0.04 0.01 0.02 0.19 0.01 -0.03 0.14 0.02 -0.10 0.16 0.04 -0.02 0.02 -0.03 0.00 0.01 -0.02 -0.01 -0.26 0.04 -0.00 -0.02 -0.03 0.01 -0.03 -0.04 -0.02 -0.18 -0.01 -0.01 0.09 -0.00 -0.02 0.02 0.04 -0.01 0.30 0.04 -0.01 0.27 -0.06 -0.05 -0.29 0.07 0.08 0.22 -0.07 -0.06 -0.23 0.06 0.07 0.29 -0.01 0.01 0.07 0.04 0.00 0.00 0.15 -0.07 -0.01 0.03 0.02 -0.01 0.03 0.08 0.05 0.09 -0.02 -0.02 0.04 -0.02 -0.02 0.04 0.00 0.01 0.03 0.08 -0.01 0.11 -0.04 -0.01 -0.04 -0.05 0.05 0.05 0.00 -0.01 0.02 0.19 -0.04 0.04 0.02 0.02 0.02 0.21 -0.02 0.04 0.05 0.03 0.03 0.12 0.02 -0.00 -0.07 -0.02 -0.06 -0.05 0.08 0.01 -0.13 -0.11 -0.02 0.06 0.03 -0.10 -0.11 0.09 -0.04 -0.19 -0.09 -0.09 -0.18 0.01 -0.03 0.01 0.03 -0.08 0.08 0.00 -0.08 -0.02 0.00 -0.13 0.05 -0.03 -0.13 -0.00 -0.03 -0.09 -0.01 0.06 -0.03 -0.11 0.05 -0.06 -0.05 0.05 0.01 0.24 -0.06 0.05 -0.05 0.04 0.02 0.02 -0.01 0.01 0.27 -0.04 0.05 -0.01 0.06 -0.06 0.00 0.15 0.04 -0.15 -0.19 -0.15 -0.10 0.17 -0.03 -0.24 -0.15 -0.13 -0.22 0.02 0.02 -0.01 0.05 -0.08 0.11 -0.00 -0.08 -0.06 0.00 -0.17 0.06 -0.04 -0.18 -0.03 -0.05 0.05 -0.05 -0.01 -0.05 0.06 0.01 0.13 -0.09 0.02 0.02 0.06 -0.03 0.04 -0.01 0.03 0.02 -0.00 0.06 0.02 -0.01 -0.01 0.02 0.00 0.01 -0.00 0.02 0.01 0.02 0.00 -0.07 0.08 -0.06 0.01 0.01 -0.13 0.06 0.03 0.17 -0.05 0.01 -0.09 0.05 0.03 0.21 -0.06 0.02 0.07 -0.01 0.01 -0.02 0.04 -0.03 -0.01 -0.10 0.03 -0.03 0.16 -0.02 0.04 -0.02 -0.05 -0.03 -0.12 0.02 -0.05 0.13 -0.03 -0.04 -0.00 -0.03 -0.02 -0.04 -0.06 0.07 -0.00 -0.08 -0.05 -0.04 -0.11 0.04 0.00 -0.12 -0.02 -0.02 0.02 -0.03 -0.10 0.02 0.01 -0.07 0.02 0.04 -0.08 -0.00 -0.25 0.09 0.03 0.27 -0.08 0.02 0.00 0.06 0.01 -0.20 0.08 0.04 0.34 -0.10 -0.06 -0.00 -0.20 0.06 -0.04 0.26 -0.08 -0.03 -0.23 0.03 -0.06 0.22 -0.04 -0.05 -0.02 0.01 -0.04 -0.05 -0.06 0.11 0.01 -0.09 -0.10 -0.06 -0.15 0.06 0.02 -0.16 -0.04 -0.02 -0.04 0.04 0.01 0.04 -0.03 -0.00 0.00 0.03 -0.01 -0.03 -0.03 -0.01 0.04 0.00 -0.02 0.03 -0.01 -0.04 -0.02 0.02 0.01 -0.02 0.04 -0.01 0.02 -0.01 -0.00 -0.05 0.00 0.05 0.00 0.03 -0.01 -0.01 0.11 -0.04 -0.03 -0.04 0.01 -0.01 0.08 -0.05 -0.03 -0.06 0.00 -0.02 -0.01 -0.02 0.04 0.00 0.00 0.03 0.00 -0.11 0.07 0.01 0.16 -0.03 -0.03 -0.02 0.05 0.01 -0.06 0.08 0.01 0.20 0.07 0.01 0.10 0.01 -0.01 0.13 -0.08 -0.06 -0.17 0.01 -0.02 0.12 -0.08 -0.06 -0.18 -0.04 -0.04 -0.04 -0.07 0.03 0.07 -0.04 -0.03 0.06 -0.05 -0.02 0.06 0.00 0.17 -0.06 -0.04 -0.08 0.03 0.05 -0.01 -0.08 -0.00 0.12 -0.06 -0.05 -0.12 0.02 0.01 -0.01 -0.24 0.07 0.01 0.24 0.04 0.00 -0.15 0.10 0.02 0.31 0.08 0.02 0.13 0.05 0.00 0.25 -0.11 -0.07 -0.27 0.05 0.00 0.24 -0.12 -0.08 -0.30 -0.04 -0.04 -0.05 -0.08 0.12 0.05 -0.23 0.13 0.04 0.28 0.03 -0.04 -0.08 -0.07 -0.09 0.16 0.03 -0.01 0.14 0.03 -0.02 -0.08 0.11 0.05 -0.07 0.05 0.03 -0.07 0.09 0.03 -0.04 0.12 0.07 0.13 0.06 -0.00 -0.03 0.03 0.01 -0.12 -0.01 0.03 -0.03 -0.03 -0.02 -0.12 -0.08 -0.01 -0.08 -0.07 -0.03 0.09 -0.02 -0.02 0.00 -0.00 0.01 0.11 -0.11 -0.04 -0.04 -0.04 -0.06 -0.06 -0.08 0.02 0.05 -0.18 -0.04 -0.04 -0.17 -0.00 -0.04 0.00 -0.06 0.02 -0.06 -0.01 0.03 0.04 -0.00 0.09 -0.02 0.05 0.09 0.03 0.06 -0.02 0.13 0.09 -0.04 0.14 0.07 -0.03 0.09 0.08 0.00 0.07 0.02 -0.15 0.01 0.04 0.12 0.06 0.03 0.00 -0.03 -0.04 -0.16 -0.11 -0.02 -0.02 0.07 0.03 0.17 -0.12 -0.07 -0.13 -0.06 0.04 0.07 -0.25 -0.05 -0.09 -0.22 0.00 -0.09 0.02 -0.11 0.02 -0.10 -0.02 0.03 0.08 -0.00 0.14 -0.04 0.09 0.15 0.06 0.12 0.07 -0.03 0.05 -0.12 -0.08 0.05 0.38 -0.09 -0.08 0.04 0.06 -0.11 -0.14 -0.01 0.02 -0.14 -0.02 -0.01 0.02 -0.06 0.08 0.03 -0.08 0.08 -0.08 -0.05 0.04 0.05 -0.05 0.08 0.13 -0.05 -0.01 0.07 0.05 0.01 -0.00 -0.16 0.08 0.08 0.11 -0.05 -0.00 -0.10 0.02 0.04 0.04 -0.05 -0.10 0.02 0.01 -0.03 0.00 0.03 -0.13 0.08 -0.02 0.02 0.05 -0.06 0.01 0.06 0.01 -0.08 0.14 -0.04 -0.01 0.12 -0.03 0.03 -0.00 -0.00 -0.04 0.07 -0.07 -0.01 -0.03 0.03 -0.08 0.05 -0.04 -0.07 -0.01 0.01 0.12 -0.03 0.13 0.05 -0.01 0.02 0.01 -0.10 0.11 0.10 0.11 0.01 -0.03 -0.25 0.13 -0.12 -0.04 -0.06 0.11 0.21 -0.10 -0.03 -0.17 0.03 -0.01 -0.05 0.06 -0.17 0.09 -0.02 0.07 0.05 0.02 -0.11 0.19 -0.07 0.02 0.16 -0.05 0.08 -0.03 0.01 -0.05 0.11 -0.11 0.00 -0.07 0.08 -0.13 0.07 -0.05 -0.10 -0.03 0.04 -0.02 -0.01 -0.01 0.34 -0.10 -0.03 0.25 -0.10 -0.03 -0.06 -0.10 0.04 -0.06 0.03 0.01 -0.05 0.03 0.04 -0.04 0.03 -0.02 -0.05 0.14 -0.05 0.10 -0.02 -0.01 -0.19 -0.06 0.04 0.07 -0.03 -0.01 -0.05 0.06 -0.02 -0.05 0.18 -0.06 -0.06 -0.04 0.01 -0.05 0.09 -0.03 -0.06 -0.05 0.01 -0.05 0.04 0.04 -0.04 0.04 0.03 -0.06 0.05 0.03 -0.04 -0.08 0.00 -0.04 0.05 -0.01 -0.05 0.06 -0.00 -0.05 0.06 -0.02 -0.04 -0.02 -0.03 0.03 -0.12 0.02 0.03 0.03 -0.01 0.11 -0.08 0.04 0.11 -0.00 0.03 -0.35 -0.02 0.02 -0.18 -0.21 0.12 -0.17 -0.03 0.02 -0.05 0.03 -0.02 -0.04 0.25 -0.09 -0.05 0.03 0.04 -0.06 -0.12 0.03 -0.05 0.11 -0.05 -0.04 0.04 0.04 -0.06 0.06 0.05 -0.03 0.05 -0.02 -0.06 0.07 -0.01 -0.05 0.07 -0.06 -0.10 0.01 -0.05 0.04 -0.17 0.04 0.03 0.09 -0.03 0.17 -0.10 0.06 0.17 0.03 0.05 -0.10 0.07 0.01 0.25 -0.04 -0.03 0.11 0.00 -0.03 -0.06 0.06 0.01 0.00 0.04 -0.00 0.05 0.04 0.02 -0.00 0.02 -0.03 -0.02 -0.13 -0.05 0.06 0.02 -0.01 0.19 0.11 -0.00 0.00 0.03 -0.01 -0.06 -0.19 -0.01 -0.02 -0.19 -0.03 -0.07 -0.16 0.01 -0.02 -0.16 -0.00 -0.06 -0.08 -0.01 0.04 0.04 0.02 0.00 0.05 0.02 0.05 0.01 0.02 -0.03 0.08 0.07 -0.03 0.02 0.00 0.02 -0.03 -0.00 -0.02 -0.02 -0.02 -0.04 0.08 0.08 -0.05 0.09 0.06 -0.07 0.07 -0.00 -0.09 0.07 -0.01 -0.10 0.06 -0.07 0.27 0.06 -0.02 0.17 0.27 0.04 0.28 0.08 -0.02 -0.09 -0.23 -0.02 -0.02 -0.21 -0.03 0.04 0.02 0.08 -0.08 -0.18 0.02 0.01 -0.17 0.02 -0.01 0.08 0.03 0.08 -0.00 0.03 -0.06 0.02 -0.00 0.03 -0.05 -0.01 -0.05 -0.04 -0.04 -0.03 0.09 0.10 -0.04 0.09 0.08 -0.08 0.05 -0.02 -0.10 0.07 -0.04 -0.13 0.05 -0.15 -0.01 0.03 -0.03 -0.08 -0.06 -0.06 -0.03 0.07 -0.10 0.01 0.00 0.01 0.04 -0.02 -0.08 -0.00 0.01 0.01 0.00 -0.01 -0.02 0.00 0.00 -0.03 -0.01 -0.03 -0.06 -0.02 -0.05 0.10 0.00 0.02 -0.07 -0.00 0.00 -0.03 0.01 0.01 -0.03 -0.00 0.00 -0.02 0.02 0.01 -0.02 0.01 0.00 -0.01 0.04 0.01 0.22 0.03 0.01 0.24 0.04 0.00 0.24 0.02 0.00 0.02 -0.01 0.01 -0.02 -0.00 0.00 -0.01 -0.05 0.00 -0.23 0.02 -0.00 0.02 0.02 0.00 0.03 0.01 -0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.01 -0.02 0.05 0.08 0.26 -0.02 -0.05 -0.02 -0.12 -0.22 0.19 -0.00 0.00 -0.03 0.02 0.01 -0.03 0.04 -0.03 -0.07 -0.01 0.00 -0.02 0.02 0.01 -0.02 0.05 0.01 0.33 0.06 0.00 0.33 -0.03 0.01 -0.10 -0.01 -0.00 -0.07 -0.10 0.00 -0.50 0.02 -0.00 0.03 0.02 0.01 0.04 0.00 -0.01 -0.02 -0.00 -0.00 -0.01 -0.02 -0.02 -0.05 -0.11 0.02 0.03 -0.08 0.06 0.02 0.04 -0.05 0.04 0.03 -0.00 0.01 -0.01 -0.01 0.03 -0.01 -0.01 0.01 -0.02 -0.00 -0.00 -0.01 0.01 -0.11 -0.02 0.01 0.02 -0.00 -0.03 0.16 -0.02 -0.01 0.03 0.00 0.02 -0.12 0.01 0.05 -0.12 -0.00 0.01 -0.11 0.02 0.04 -0.11 0.02 -0.01 -0.09 -0.03 -0.02 -0.05 -0.01 -0.02 -0.06 -0.03 -0.00 -0.06 0.08 0.01 0.18 0.01 -0.01 0.00 -0.01 0.01 -0.00 0.01 0.01 0.05 0.08 0.01 0.19 0.09 0.02 0.21 0.02 -0.02 -0.02 0.03 -0.02 -0.00 -0.03 -0.05 -0.19 0.00 0.09 0.28 -0.00 -0.02 0.15 -0.01 -0.19 0.22 0.01 0.02 -0.12 0.01 0.07 -0.13 -0.02 0.00 0.02 -0.01 0.01 -0.11 0.02 0.06 -0.12 -0.01 -0.03 -0.08 -0.05 -0.00 -0.08 0.02 -0.01 0.02 -0.01 0.02 0.02 0.03 0.02 0.12 0.10 0.02 0.25 0.11 0.03 0.28 -0.00 -0.03 -0.10 0.01 -0.03 -0.05 -0.10 -0.09 -0.42 0.00 -0.01 -0.01 0.01 0.03 -0.01 -0.00 -0.03 0.02 -0.01 -0.01 0.04 -0.01 0.00 0.01 0.00 0.00 0.01 0.01 -0.01 -0.02 0.01 -0.02 -0.02 0.01 0.00 -0.01 0.06 -0.00 0.06 -0.00 -0.01 0.00 -0.01 0.00 -0.02 0.01 0.00 -0.02 -0.02 0.02 0.00 0.01 0.02 -0.01 -0.01 0.01 0.01 -0.00 0.00 -0.01 -0.00 0.00 -0.02 -0.00 0.00 -0.02 -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.02 -0.04 0.00 -0.04 -0.03 -0.02 -0.03 -0.01 0.02 0.00 0.00 -0.01 0.00 0.02 0.02 0.04 0.47 0.19 0.42 0.06 0.14 -0.43 -0.31 -0.35 0.29 -0.03 0.00 -0.02 0.02 0.00 -0.03 -0.00 0.00 0.03 -0.03 0.02 0.01 0.03 0.03 0.00 -0.00 0.00 -0.03 -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.04 -0.06 0.01 -0.05 -0.03 -0.04 -0.05 -0.01 0.03 0.01 0.02 -0.02 0.01 0.04 0.03 0.08 -0.07 0.02 0.04 -0.03 -0.06 0.02 0.03 0.00 -0.01 -0.02 -0.03 0.10 -0.01 -0.03 0.01 -0.04 -0.04 -0.02 0.02 -0.02 0.02 0.01 -0.03 -0.05 -0.01 -0.02 0.02 0.22 0.09 -0.00 -0.01 -0.00 0.02 -0.02 0.05 -0.06 0.03 0.04 -0.06 -0.02 0.11 -0.04 0.03 0.10 -0.04 -0.01 0.06 -0.01 -0.03 -0.04 0.02 0.01 -0.05 0.02 -0.03 -0.02 0.03 -0.06 -0.05 0.00 0.03 -0.03 -0.01 -0.01 0.01 0.00 0.02 0.00 -0.03 -0.07 -0.00 -0.03 -0.03 -0.07 -0.02 -0.01 0.03 -0.00 0.03 -0.04 0.00 0.05 0.02 0.04 0.10 -0.09 -0.24 0.20 0.22 0.34 0.55 0.26 -0.17 -0.04 0.04 -0.07 0.04 0.04 -0.07 -0.02 -0.03 -0.07 -0.04 0.13 -0.04 0.06 0.12 -0.03 0.02 -0.08 0.03 -0.06 -0.02 0.04 0.06 -0.03 -0.01 -0.02 0.04 0.00 0.03 0.02 -0.06 -0.12 0.02 -0.03 -0.04 -0.11 -0.03 -0.01 0.08 -0.00 0.07 -0.06 0.01 0.10 0.04 0.08 -0.05 0.01 -0.02 -0.04 0.10 -0.03 0.00 -0.04 0.01 0.03 0.02 0.10 0.02 0.01 -0.00 0.02 0.03 0.02 0.02 -0.02 -0.04 0.02 -0.02 -0.08 0.03 0.01 -0.03 -0.04 -0.10 0.19 -0.00 -0.01 -0.01 -0.02 -0.05 -0.05 0.07 -0.06 -0.05 -0.02 -0.04 0.02 0.08 -0.04 0.02 0.03 -0.00 0.04 0.01 0.03 -0.01 -0.01 0.03 -0.02 0.01 0.02 -0.02 0.00 0.02 -0.05 -0.02 0.03 0.00 -0.00 0.01 -0.00 -0.01 0.01 0.02 -0.01 -0.00 -0.09 -0.03 0.02 -0.09 -0.01 -0.00 0.00 -0.03 0.03 -0.01 -0.00 0.02 0.09 -0.42 -0.05 0.09 -0.03 -0.26 0.59 0.26 -0.08 0.09 -0.05 -0.08 -0.07 0.11 -0.08 -0.06 0.01 0.03 0.06 -0.07 -0.06 0.05 0.12 -0.05 0.05 -0.02 0.05 -0.04 0.01 0.02 -0.03 -0.03 0.03 0.01 0.00 -0.00 -0.00 -0.02 0.00 0.05 -0.00 -0.01 -0.12 -0.04 0.04 -0.12 -0.00 -0.02 0.02 -0.04 0.04 0.01 0.02 0.03 0.20 0.10 0.01 -0.01 0.03 0.17 0.02 -0.02 0.03 0.08 -0.05 -0.02 -0.03 0.24 -0.03 0.00 -0.11 -0.04 -0.11 0.06 0.03 -0.01 0.03 0.04 -0.02 0.10 0.03 0.01 -0.01 -0.01 0.01 0.12 0.02 0.03 0.01 -0.01 0.00 -0.01 -0.01 -0.02 0.00 -0.08 0.01 -0.02 -0.08 -0.01 -0.04 -0.06 -0.01 -0.12 -0.12 0.01 -0.01 -0.15 0.04 -0.15 -0.04 0.04 -0.05 -0.00 0.01 0.08 -0.05 -0.01 -0.07 0.08 0.01 0.04 0.06 -0.04 -0.06 0.04 0.02 -0.04 -0.00 0.02 -0.04 0.06 0.00 -0.02 0.01 0.00 -0.02 0.05 -0.01 -0.06 0.02 0.02 -0.01 -0.07 0.02 -0.03 -0.01 0.02 0.01 -0.01 -0.00 -0.02 0.01 -0.01 -0.02 0.13 -0.61 0.03 -0.12 0.00 -0.01 -0.10 -0.00 0.02 -0.24 0.07 -0.23 -0.02 0.05 0.18 -0.07 -0.01 -0.10 0.18 0.01 0.09 0.13 -0.09 -0.09 0.06 0.02 -0.04 -0.02 0.02 -0.04 0.08 0.00 0.00 -0.00 -0.01 -0.01 0.06 -0.03 0.26 -0.07 -0.02 -0.09 -0.06 0.02 -0.05 0.04 -0.01 -0.09 -0.05 -0.05 -0.00 0.01 -0.00 0.06 0.05 0.05 0.12 -0.07 0.03 0.07 -0.04 0.02 0.04 -0.04 0.01 0.04 -0.13 0.05 0.06 -0.01 -0.01 0.06 -0.01 0.01 -0.00 -0.02 -0.03 0.04 0.01 -0.06 -0.02 -0.02 -0.09 -0.05 -0.01 -0.09 0.06 0.10 -0.01 -0.01 0.12 -0.03 0.07 0.06 -0.04 -0.16 -0.06 0.07 -0.07 0.07 0.01 0.03 -0.01 -0.01 -0.05 0.01 0.04 -0.17 0.06 0.08 -0.10 -0.09 0.09 -0.07 0.14 0.00 0.01 -0.04 0.01 -0.00 0.08 -0.05 -0.13 -0.13 -0.02 0.05 -0.24 0.21 0.14 -0.06 -0.00 0.06 -0.02 0.01 -0.05 -0.01 -0.00 0.03 0.00 0.18 0.12 0.01 -0.10 -0.02 -0.01 -0.09 -0.04 0.19 -0.05 0.12 0.05 -0.05 -0.13 0.08 0.01 0.05 -0.07 -0.01 -0.08 -0.03 0.08 -0.28 0.13 0.11 -0.09 -0.18 0.10 -0.08 0.23 -0.02 0.11 -0.10 -0.02 0.06 0.12 -0.13 0.05 0.01 -0.00 0.04 0.12 -0.06 0.02 0.15 -0.16 -0.01 -0.01 -0.03 -0.12 -0.01 0.01 0.04 -0.00 0.19 0.01 0.00 -0.02 0.01 0.01 0.02 -0.01 0.03 -0.05 0.01 -0.01 0.03 -0.03 0.01 -0.04 0.01 0.01 0.02 -0.00 0.01 0.01 0.01 -0.01 0.01 -0.01 -0.00 0.00 -0.01 -0.01 -0.00 -0.06 -0.09 0.04 0.01 -0.13 -0.04 -0.07 -0.07 0.00 -0.02 -0.01 0.01 0.08 -0.08 -0.01 -0.02 -0.00 -0.01 0.07 -0.02 0.03 -0.02 0.01 0.01 -0.01 -0.01 0.01 -0.01 0.02 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.05 0.01 0.03 0.01 -0.02 0.10 0.06 -0.02 0.02 0.02 0.01 0.02 -0.02 0.01 0.02 -0.14 -0.03 0.80 0.03 -0.01 0.00 -0.01 -0.01 0.00 0.03 -0.21 -0.09 -0.12 -0.06 0.02 0.13 -0.09 -0.03 -0.05 0.07 -0.02 0.12 0.02 0.06 -0.03 0.02 0.01 -0.01 -0.02 0.01 -0.01 0.03 -0.00 0.01 -0.01 -0.00 0.00 0.01 -0.02 0.03 -0.03 -0.08 0.12 0.26 -0.07 -0.01 -0.11 0.03 -0.01 -0.00 -0.12 -0.20 0.03 0.01 -0.09 -0.06 -0.16 -0.02 -0.03 -0.04 -0.01 -0.03 0.10 -0.05 0.04 -0.06 0.08 -0.02 0.12 -0.06 -0.01 -0.02 0.01 0.01 0.09 -0.04 0.00 0.10 0.03 0.08 0.04 -0.05 0.06 0.05 -0.01 0.06 0.01 0.05 0.03 -0.03 0.06 0.02 0.05 0.08 -0.02 0.03 -0.03 -0.03 0.01 0.01 -0.02 0.01 0.05 -0.07 0.02 0.01 -0.07 -0.06 -0.02 -0.01 0.04 0.00 -0.04 0.04 0.00 0.00 0.01 0.03 -0.03 0.01 0.02 -0.02 -0.04 -0.04 0.01 0.10 0.07 0.04 0.37 0.32 -0.10 0.07 0.04 -0.00 0.11 -0.06 -0.00 0.11 0.04 -0.14 -0.47 0.05 0.11 0.01 -0.06 0.08 0.03 0.06 0.05 0.11 0.12 -0.02 0.04 -0.04 -0.01 0.03 0.06 -0.10 0.04 -0.02 -0.09 -0.12 -0.03 0.00 0.06 0.00 -0.07 0.05 0.00 0.03 0.00 0.05 -0.04 0.01 0.02 -0.02 -0.09 -0.03 -0.04 -0.09 -0.03 -0.09 -0.11 -0.08 -0.17 0.01 -0.02 -0.00 -0.14 0.22 -0.05 -0.10 0.08 0.06 0.10 -0.02 0.01 -0.05 -0.03 0.07 0.07 0.04 -0.02 -0.12 0.15 0.06 0.11 0.03 -0.10 -0.08 -0.02 0.07 0.09 -0.06 0.06 0.09 -0.01 0.03 0.08 -0.08 0.01 0.09 -0.04 -0.01 0.06 -0.03 -0.01 0.02 -0.06 0.01 -0.04 -0.06 0.03 -0.03 0.01 0.00 -0.02 -0.03 0.04 -0.00 -0.04 0.07 -0.02 -0.03 0.07 0.05 0.04 -0.01 0.02 0.03 0.01 0.02 0.02 -0.03 0.01 0.01 -0.00 0.01 -0.00 -0.03 -0.03 0.13 0.07 0.13 0.13 0.23 0.35 0.41 -0.07 0.08 -0.00 0.08 0.09 -0.07 0.08 0.09 -0.01 0.12 0.31 -0.00 0.05 0.07 -0.09 -0.00 0.09 -0.07 -0.00 -0.09 -0.09 0.04 -0.03 0.01 0.03 -0.02 -0.05 0.09 -0.04 -0.01 0.08 0.10 0.06 -0.02 0.03 0.04 0.01 0.03 0.02 -0.03 0.02 0.00 0.01 0.01 -0.02 -0.04 -0.08 -0.16 0.06 0.02 0.06 0.08 -0.02 0.01 0.04 -0.04 0.05 0.05 -0.04 0.19 -0.03 -0.03 0.05 0.03 0.02 -0.05 -0.03 0.01 -0.02 -0.23 0.08 0.02 0.01 -0.02 -0.12 -0.06 -0.06 0.02 0.01 -0.02 0.00 -0.20 0.07 0.01 -0.16 0.08 0.03 0.17 -0.04 0.04 0.14 -0.01 0.06 0.23 -0.05 -0.02 -0.01 0.01 -0.04 0.00 -0.02 -0.03 0.03 -0.01 -0.07 -0.05 0.03 -0.02 0.03 0.00 -0.03 0.05 -0.01 -0.03 0.05 0.02 -0.07 -0.05 0.04 -0.02 -0.10 0.03 0.00 0.00 -0.00 0.07 -0.08 -0.00 0.07 -0.04 -0.02 -0.15 -0.07 -0.08 -0.11 -0.17 -0.15 -0.23 0.01 -0.05 -0.00 -0.32 0.11 0.03 -0.26 0.10 0.02 0.10 0.04 0.01 0.25 -0.05 0.04 0.18 -0.03 -0.05 0.01 -0.04 -0.06 0.03 -0.00 0.01 0.02 -0.00 -0.03 0.06 -0.03 -0.02 0.06 0.05 -0.12 -0.02 0.05 -0.02 -0.18 0.03 -0.00 0.08 -0.02 0.11 -0.10 -0.01 0.10 -0.02 -0.05 0.21 -0.07 0.02 0.05 0.10 0.06 -0.00 0.15 -0.06 -0.10 0.02 0.07 0.07 -0.03 0.04 0.00 -0.02 0.01 0.00 -0.10 0.03 -0.11 -0.13 -0.02 0.02 -0.03 0.06 0.09 -0.08 0.02 0.10 0.01 0.01 -0.21 -0.02 -0.03 -0.13 -0.04 -0.05 -0.21 0.09 -0.03 -0.13 0.09 -0.03 -0.15 0.03 0.01 0.02 0.02 0.00 -0.01 0.04 0.00 0.02 0.03 -0.02 0.09 0.07 -0.05 -0.04 0.03 -0.01 0.00 0.02 -0.00 -0.03 0.02 0.02 0.14 -0.05 -0.02 0.13 0.06 -0.04 0.06 -0.14 0.01 0.03 0.01 0.01 0.02 -0.12 -0.00 0.09 -0.12 -0.03 0.08 -0.01 0.09 0.17 -0.06 -0.02 -0.26 -0.03 -0.07 -0.10 -0.02 -0.07 0.04 -0.01 -0.12 -0.26 0.18 -0.03 -0.09 0.18 -0.04 -0.02 0.07 0.01 0.02 0.03 -0.04 -0.04 0.03 -0.02 0.01 -0.01 0.00 -0.04 0.01 0.03 0.29 -0.12 -0.01 0.14 0.11 -0.02 0.06 -0.19 0.02 -0.06 0.07 0.06 -0.03 -0.16 0.01 0.01 0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 0.01 -0.00 0.00 -0.02 -0.01 0.01 0.00 -0.00 -0.00 -0.02 0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.00 0.01 0.00 -0.00 0.00 0.00 0.01 0.01 -0.01 0.04 -0.02 0.00 -0.04 0.00 -0.01 -0.04 0.02 0.01 0.04 -0.00 -0.00 0.01 0.01 -0.00 0.00 -0.01 -0.03 0.00 -0.19 0.04 -0.00 0.21 -0.00 0.00 -0.00 0.03 -0.00 0.21 -0.03 -0.00 -0.20 -0.00 -0.00 -0.01 0.00 -0.00 0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 -0.02 0.09 -0.04 0.01 -0.09 0.02 -0.00 -0.00 -0.01 -0.03 -0.07 0.04 0.02 0.09 -0.01 -0.07 -0.00 -0.41 0.07 0.00 0.44 0.08 -0.00 0.46 -0.07 -0.00 -0.42 -0.01 -0.00 -0.04 0.01 0.00 0.03 -0.01 -0.01 -0.03 -0.01 -0.00 -0.03 0.01 0.00 0.03 0.00 -0.01 -0.01 0.03 -0.01 -0.02 0.02 0.00 -0.02 -0.02 -0.03 0.01 0.00 -0.01 0.16 0.00 0.00 -0.02 0.01 0.01 -0.01 -0.03 0.02 0.01 -0.02 -0.00 0.07 -0.02 0.01 -0.02 -0.01 0.03 0.02 0.01 -0.01 -0.02 0.04 -0.17 0.09 -0.05 0.17 -0.01 0.05 0.15 -0.15 -0.05 -0.17 -0.03 0.01 -0.02 -0.09 -0.00 -0.00 -0.00 -0.01 -0.01 -0.05 0.00 -0.00 0.05 0.03 0.01 0.02 0.01 -0.00 0.05 -0.01 -0.00 -0.05 0.00 -0.00 -0.00 0.01 0.00 -0.06 0.02 0.02 0.02 0.01 -0.00 0.03 -0.03 0.01 -0.05 -0.01 0.01 0.03 -0.00 0.03 0.02 -0.02 0.07 0.04 0.03 0.00 0.01 0.10 -0.38 0.20 -0.10 0.37 -0.04 -0.00 0.01 0.02 0.14 0.29 -0.25 -0.16 -0.38 -0.02 -0.02 -0.01 -0.10 0.01 -0.00 0.11 0.02 -0.01 0.11 -0.02 0.01 -0.10 0.00 0.00 -0.01 -0.00 -0.01 -0.12 0.03 0.06 0.05 0.02 -0.02 0.06 -0.06 0.00 -0.11 -0.01 0.01 0.07 -0.01 0.00 0.01 -0.00 0.00 0.01 0.01 0.01 -0.00 -0.00 0.00 -0.05 -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 -0.00 0.01 0.00 -0.01 -0.01 -0.00 0.00 0.01 -0.02 0.02 -0.02 0.01 -0.02 -0.01 -0.01 -0.01 0.03 0.01 0.03 0.02 -0.00 0.00 0.03 0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.01 -0.01 -0.01 -0.01 -0.00 0.00 0.01 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 -0.07 -0.04 -0.19 0.06 0.03 0.21 0.07 0.03 0.20 -0.06 -0.03 -0.19 0.00 -0.00 -0.01 0.00 -0.01 -0.01 0.01 -0.02 -0.02 -0.01 -0.00 -0.01 -0.04 0.05 -0.04 0.03 -0.04 -0.01 0.00 -0.01 -0.01 -0.04 -0.02 0.05 0.04 0.06 0.03 -0.00 0.01 -0.01 0.01 0.00 0.01 -0.00 0.00 0.02 -0.00 0.00 -0.01 -0.00 -0.00 0.00 -0.13 -0.06 -0.39 0.13 0.05 0.42 0.14 0.07 0.44 -0.12 -0.08 -0.42 -0.00 -0.00 -0.03 0.04 -0.01 -0.03 0.03 0.00 -0.04 -0.02 -0.05 0.01 0.01 -0.01 0.21 0.02 0.00 -0.03 0.02 0.02 -0.01 -0.04 0.03 0.02 -0.03 -0.01 0.11 -0.03 0.02 -0.03 -0.02 0.05 0.03 0.01 -0.02 -0.03 0.06 0.12 0.02 -0.09 -0.15 0.13 0.04 -0.16 -0.09 -0.04 0.14 -0.18 0.02 -0.01 -0.15 -0.01 -0.01 -0.00 -0.00 -0.01 0.02 -0.01 -0.00 -0.01 0.04 0.01 0.05 0.00 -0.00 -0.01 -0.00 0.01 0.02 0.00 0.00 -0.00 0.01 0.01 -0.05 0.01 0.02 0.01 0.00 -0.00 0.00 -0.03 0.01 -0.04 -0.00 0.01 0.04 -0.02 0.05 0.02 -0.02 0.09 0.08 0.04 0.03 0.02 0.18 0.29 0.04 -0.18 -0.31 0.24 -0.01 0.02 0.07 0.15 -0.35 -0.10 -0.18 0.27 -0.31 0.00 -0.01 0.04 -0.02 -0.00 -0.02 0.01 -0.00 -0.03 0.00 0.01 0.04 0.00 0.01 -0.00 0.00 -0.01 -0.11 0.01 0.05 0.00 0.00 -0.03 -0.01 -0.05 0.00 -0.10 0.00 0.01 0.08 0.22 0.06 -0.13 -0.03 -0.18 0.00 -0.01 -0.08 0.17 0.01 0.07 -0.04 -0.07 0.15 -0.00 0.00 0.12 -0.01 -0.02 0.14 -0.04 -0.03 -0.01 -0.07 -0.05 0.08 0.00 -0.08 0.14 0.08 0.03 0.10 0.01 -0.08 -0.12 -0.03 0.01 -0.11 -0.03 -0.08 0.04 -0.00 0.01 0.03 0.01 -0.01 0.15 -0.01 -0.08 -0.02 -0.03 0.03 -0.07 0.03 -0.05 -0.09 0.01 -0.03 0.01 0.00 0.09 -0.05 -0.01 0.00 -0.04 0.04 0.08 -0.06 -0.05 -0.02 -0.05 0.01 0.02 -0.03 0.01 0.01 -0.04 0.01 0.05 -0.04 -0.01 0.05 -0.06 -0.01 -0.21 0.25 0.14 -0.07 0.07 0.20 -0.00 0.04 0.09 -0.14 -0.26 -0.02 0.07 -0.22 -0.03 -0.10 0.16 0.29 -0.15 0.01 0.05 0.05 -0.03 0.06 0.07 -0.17 0.09 -0.04 -0.08 0.05 0.09 -0.05 0.01 -0.01 0.04 0.11 0.10 -0.03 -0.08 -0.00 -0.06 0.01 0.02 -0.08 0.01 0.01 0.01 0.01 0.04 -0.03 -0.01 0.05 -0.06 -0.02 0.03 -0.01 -0.01 0.00 -0.02 -0.02 -0.01 0.03 -0.02 0.02 0.03 -0.01 -0.00 -0.01 0.00 -0.11 -0.02 0.11 -0.03 0.03 -0.01 -0.01 0.03 -0.01 -0.03 0.01 -0.02 -0.02 0.05 0.02 0.02 -0.01 0.00 -0.00 -0.01 -0.01 0.00 -0.01 0.01 -0.00 -0.01 -0.01 0.01 -0.01 0.01 0.02 0.04 -0.01 0.04 0.03 0.21 0.03 0.02 -0.04 0.01 -0.01 -0.02 -0.01 0.00 0.03 0.00 -0.01 -0.08 -0.00 -0.03 -0.11 0.05 -0.04 0.14 -0.02 -0.01 0.00 -0.01 -0.01 0.00 -0.00 -0.00 -0.01 0.01 -0.01 -0.01 0.02 -0.00 0.01 -0.02 0.07 0.04 -0.02 0.08 0.05 0.02 0.02 0.02 0.00 -0.05 0.01 0.01 -0.05 0.01 0.13 -0.06 -0.66 -0.02 -0.05 0.01 -0.00 -0.05 0.01 -0.01 0.01 -0.26 0.01 -0.01 -0.25 -0.07 0.00 -0.28 -0.04 -0.03 -0.33 0.06 -0.04 0.22 -0.03 -0.01 -0.03 -0.02 -0.04 -0.03 -0.01 0.01 -0.04 0.00 -0.02 -0.05 0.02 -0.00 0.02 0.02 -0.05 0.02 0.00 0.02 0.02 -0.01 0.02 -0.04 0.05 0.11 -0.08 0.00 -0.04 0.01 0.03 -0.04 -0.02 -0.02 -0.00 0.00 -0.03 0.08 -0.03 0.01 -0.02 0.02 0.01 0.03 0.01 0.01 -0.04 0.01 -0.02 0.00 -0.02 -0.02 0.02 -0.01 -0.02 -0.04 0.00 -0.02 -0.04 0.03 0.01 0.05 -0.01 0.01 -0.01 -0.06 -0.01 0.00 0.01 0.01 0.03 -0.00 0.03 0.06 0.27 -0.02 0.01 0.02 0.00 0.02 0.03 -0.04 0.03 -0.03 -0.05 -0.05 0.01 -0.01 -0.02 -0.00 -0.03 -0.04 -0.10 0.01 -0.03 -0.13 0.10 -0.02 0.16 0.05 0.01 0.01 0.00 0.09 0.02 0.05 0.00 0.01 -0.02 -0.06 0.00 -0.01 -0.04 0.01 -0.00 -0.04 0.08 -0.05 -0.10 0.04 -0.03 -0.13 0.05 -0.01 0.04 0.07 0.01 0.03 0.06 0.00 0.00 0.08 0.02 -0.01 0.08 -0.04 0.02 -0.04 -0.14 -0.10 -0.31 -0.11 -0.15 -0.29 -0.13 -0.02 -0.42 -0.09 -0.09 -0.43 0.11 -0.01 0.20 0.05 -0.10 0.04 0.01 0.02 0.01 -0.02 0.04 -0.08 0.06 0.06 0.05 0.00 -0.08 0.03 0.02 -0.10 0.01 -0.07 0.04 0.00 -0.04 0.17 -0.06 -0.01 -0.01 0.02 -0.02 0.11 0.03 0.01 -0.09 0.02 -0.01 -0.03 -0.02 0.01 -0.01 0.02 -0.00 -0.07 -0.02 0.02 -0.05 0.02 0.06 0.15 -0.06 0.04 -0.02 -0.07 -0.02 0.01 -0.00 0.03 0.05 -0.01 -0.08 -0.02 -0.14 -0.04 0.00 0.04 0.01 0.03 0.03 -0.07 0.04 -0.03 -0.04 -0.03 0.01 -0.01 -0.02 0.00 0.02 0.01 0.07 0.05 -0.00 0.06 -0.00 -0.03 -0.10 0.05 0.11 0.06 -0.04 0.24 0.08 0.06 0.05 0.03 0.01 -0.26 0.07 0.03 -0.23 0.08 0.04 -0.11 -0.06 -0.04 -0.32 0.08 -0.04 -0.32 0.08 -0.03 0.07 0.09 0.01 0.06 0.08 -0.01 -0.00 0.12 0.04 -0.02 0.10 -0.07 0.04 -0.03 0.01 0.01 0.20 0.04 -0.03 0.19 0.08 0.08 0.26 0.12 0.02 0.25 -0.00 -0.03 -0.12 0.11 -0.07 -0.03 0.07 -0.00 0.03 -0.03 0.02 -0.04 0.08 -0.14 -0.06 0.04 -0.05 0.01 0.04 -0.06 0.00 -0.16 0.06 0.02 -0.08 -0.18 0.00 -0.14 0.03 0.04 -0.10 0.18 0.07 0.04 -0.05 -0.01 0.01 -0.04 -0.11 0.03 -0.00 -0.02 0.03 0.05 -0.03 0.05 0.07 0.06 0.09 -0.14 0.09 0.04 -0.03 -0.03 -0.02 -0.01 0.00 0.01 0.03 -0.01 0.06 -0.09 0.03 -0.03 -0.01 0.01 -0.00 0.03 0.01 -0.05 0.04 -0.01 0.05 0.05 -0.01 -0.07 -0.01 0.02 0.02 0.07 -0.03 -0.08 0.02 0.01 -0.07 0.13 0.02 -0.10 0.21 0.10 -0.12 0.29 0.18 0.02 0.10 0.07 0.03 0.18 -0.17 0.16 0.18 -0.15 0.06 -0.06 -0.05 -0.08 0.33 -0.04 0.09 0.32 -0.02 -0.03 0.03 0.04 -0.03 0.04 0.03 0.01 -0.02 0.04 0.02 -0.00 0.04 -0.05 0.04 -0.00 -0.07 0.10 -0.03 -0.08 0.09 -0.03 0.01 -0.02 -0.07 -0.02 -0.03 -0.05 -0.07 0.13 0.02 -0.03 -0.01 0.00 -0.01 -0.03 -0.04 0.00 0.03 -0.04 -0.01 -0.02 -0.00 0.05 0.01 0.01 -0.15 0.04 0.26 0.00 0.01 -0.02 0.00 -0.02 0.01 0.01 0.01 -0.04 0.00 -0.00 -0.00 0.02 -0.03 0.01 0.00 -0.00 0.01 -0.00 -0.01 0.01 0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.00 -0.01 0.00 -0.06 0.06 -0.17 0.05 0.06 -0.06 -0.00 -0.02 -0.04 0.01 -0.00 0.01 0.05 0.02 0.08 0.02 -0.06 0.08 0.04 -0.07 -0.13 0.01 0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.01 0.00 -0.00 -0.00 0.01 0.01 -0.02 0.02 0.01 0.00 -0.02 0.01 0.01 -0.03 0.00 0.01 0.02 0.01 -0.01 0.01 0.01 0.08 0.09 -0.59 0.02 0.04 -0.02 -0.00 0.04 -0.02 0.12 0.02 0.25 0.12 -0.04 0.20 0.03 0.03 0.40 0.06 -0.03 0.35 0.04 -0.08 -0.08 0.00 0.01 -0.01 -0.00 0.02 -0.01 -0.00 -0.01 -0.02 -0.01 -0.00 -0.02 -0.00 0.01 0.01 -0.03 -0.07 -0.05 0.02 0.03 0.19 -0.03 -0.03 -0.12 0.11 -0.08 -0.00 0.07 0.07 -0.01 -0.06 0.15 -0.08 -0.05 -0.08 0.02 -0.10 0.09 -0.03 0.03 0.00 0.15 0.06 -0.10 -0.02 -0.00 -0.03 -0.11 -0.04 -0.01 -0.05 -0.06 0.02 0.05 -0.02 -0.03 -0.03 -0.05 0.01 0.07 0.09 0.09 -0.02 -0.12 0.08 0.04 0.01 0.08 0.01 -0.04 -0.11 0.02 0.04 -0.11 0.01 0.07 0.11 -0.02 0.02 -0.08 -0.01 0.13 -0.09 -0.01 0.05 -0.02 -0.01 -0.10 -0.01 0.04 0.10 0.03 -0.04 -0.05 0.04 0.01 -0.04 0.12 -0.00 0.16 -0.13 -0.01 0.05 0.05 0.02 0.14 -0.15 -0.02 0.00 -0.19 0.04 -0.01 -0.17 0.07 -0.19 0.22 0.25 -0.13 -0.22 0.09 -0.15 -0.22 0.09 0.05 -0.07 -0.08 0.05 -0.13 -0.05 -0.04 0.13 -0.06 -0.03 0.05 -0.05 0.08 -0.14 -0.03 -0.07 0.05 0.01 -0.10 0.06 0.02 0.09 -0.04 -0.04 0.04 -0.02 -0.02 -0.09 0.08 0.02 -0.01 -0.06 -0.02 0.04 0.02 0.11 -0.04 -0.04 -0.10 0.01 0.21 0.01 0.05 0.02 -0.02 -0.02 0.07 -0.03 -0.05 -0.01 0.04 0.00 -0.14 0.06 -0.06 0.03 0.09 -0.03 0.04 0.03 0.00 -0.05 -0.08 0.03 0.06 -0.03 0.05 0.07 -0.02 0.02 -0.08 -0.02 0.05 -0.08 -0.01 0.00 -0.13 0.03 -0.05 0.03 0.01 -0.01 0.03 0.00 -0.02 -0.06 0.00 -0.11 0.11 -0.03 0.03 0.06 -0.00 0.02 -0.03 -0.00 0.06 -0.03 -0.01 -0.14 -0.06 0.02 0.02 0.01 -0.04 -0.07 -0.04 0.06 0.10 0.01 0.00 0.07 -0.14 -0.05 -0.03 0.04 0.03 -0.04 0.08 0.06 -0.01 0.03 0.02 0.09 0.43 -0.12 0.05 0.40 -0.12 -0.06 0.10 0.06 0.08 0.21 -0.13 0.07 0.21 -0.11 0.01 -0.03 -0.02 0.01 -0.06 -0.01 -0.01 0.06 -0.00 -0.00 0.03 -0.01 0.03 -0.06 -0.01 -0.02 -0.10 0.09 0.05 -0.17 0.06 -0.04 0.14 0.15 0.06 0.07 0.12 0.10 -0.12 -0.04 -0.01 -0.10 0.07 -0.00 0.02 0.05 -0.04 -0.05 -0.11 -0.11 -0.05 -0.01 0.01 -0.00 -0.02 -0.04 0.03 -0.07 0.03 0.05 0.05 0.08 0.05 -0.05 0.06 0.04 0.04 -0.06 0.12 0.03 -0.02 -0.11 -0.04 0.08 -0.05 0.01 0.00 -0.08 -0.07 0.07 0.07 0.07 -0.00 0.05 -0.02 -0.06 0.04 0.02 -0.05 0.03 0.02 -0.01 0.04 0.01 -0.01 -0.05 0.01 0.10 0.07 -0.02 0.02 0.07 -0.01 0.02 -0.03 -0.01 0.05 -0.03 0.00 0.06 0.24 -0.03 0.24 -0.06 -0.04 -0.24 0.06 0.04 -0.06 -0.24 0.03 -0.07 -0.06 0.07 -0.07 0.13 0.04 -0.05 0.07 0.01 -0.09 0.13 0.04 0.01 -0.21 0.02 -0.01 -0.21 -0.02 -0.10 0.05 0.11 0.10 -0.02 0.08 0.10 -0.00 0.07 0.00 -0.01 -0.04 0.02 -0.06 -0.03 -0.03 0.08 -0.04 -0.00 0.03 -0.04 0.01 -0.07 -0.01 0.18 0.15 -0.12 0.22 0.08 -0.11 -0.26 -0.08 -0.02 -0.20 -0.18 -0.02 0.16 0.08 -0.05 0.02 -0.02 0.09 -0.01 0.00 -0.10 0.01 0.02 0.03 -0.03 -0.02 0.01 -0.04 -0.03 -0.00 -0.02 -0.03 0.00 0.02 0.02 0.01 0.03 -0.00 -0.01 0.02 -0.00 -0.08 -0.02 0.05 0.01 -0.00 -0.03 0.06 0.02 -0.02 0.00 -0.01 -0.03 -0.04 0.02 0.02 0.03 -0.02 0.01 -0.01 -0.03 -0.00 0.01 -0.07 -0.11 0.01 -0.29 0.00 0.05 0.05 -0.29 -0.00 -0.02 -0.01 0.01 -0.04 0.33 0.01 0.34 0.01 -0.06 0.08 0.10 -0.01 -0.00 -0.06 0.01 -0.05 0.03 0.01 0.07 -0.03 -0.02 0.01 0.08 -0.02 0.03 0.01 -0.00 -0.03 0.03 -0.01 -0.02 0.01 -0.02 -0.06 0.09 0.01 -0.01 -0.03 -0.02 -0.03 -0.03 -0.03 0.00 -0.03 -0.08 0.03 0.03 0.02 0.02 0.03 0.01 -0.25 -0.13 0.04 -0.12 -0.24 0.02 0.11 0.29 -0.02 0.29 0.14 -0.07 -0.19 -0.20 0.03 -0.02 -0.05 0.01 -0.05 0.01 0.03 0.07 -0.00 -0.03 0.04 0.07 -0.02 -0.05 -0.03 0.04 0.00 -0.09 0.15 -0.02 0.03 -0.05 -0.03 -0.05 -0.07 -0.11 -0.05 0.04 0.00 -0.03 -0.05 -0.05 0.02 -0.08 0.07 0.07 0.09 0.10 -0.00 -0.05 0.11 0.03 -0.04 -0.07 0.15 0.04 -0.01 -0.12 -0.00 0.12 -0.06 -0.01 -0.07 -0.09 -0.13 0.10 0.08 0.11 -0.07 0.05 -0.01 -0.09 -0.00 0.05 -0.03 0.09 0.01 0.13 0.06 -0.01 -0.03 0.07 0.01 -0.06 -0.00 0.02 0.04 -0.05 -0.01 -0.12 -0.04 0.02 0.03 -0.08 0.00 -0.01 -0.16 0.03 -0.12 0.09 0.03 0.17 -0.08 -0.05 0.04 0.21 -0.05 0.07 0.01 -0.01 -0.09 0.12 0.00 -0.06 0.03 -0.05 -0.18 0.25 0.04 0.00 -0.11 -0.06 -0.09 -0.13 -0.11 -0.15 0.03 0.24 0.14 0.08 0.09 0.07 0.11 0.06 0.12 0.05 -0.08 0.09 0.04 -0.05 -0.10 -0.03 -0.04 -0.13 -0.04 -0.02 0.09 0.00 -0.04 -0.04 -0.14 0.03 -0.12 -0.00 0.03 0.17 -0.01 -0.08 0.06 0.19 -0.08 -0.14 -0.11 0.07 -0.03 -0.06 0.04 -0.01 -0.01 0.05 -0.01 -0.01 -0.07 -0.10 -0.08 -0.09 0.00 -0.00 0.01 -0.01 -0.00 -0.05 0.04 0.05 -0.03 0.08 0.05 0.08 0.06 0.03 0.04 -0.04 0.10 0.03 -0.02 -0.07 -0.00 -0.24 0.04 0.24 0.29 0.00 0.15 -0.23 0.03 -0.11 0.28 -0.04 -0.19 -0.07 -0.04 -0.08 -0.01 0.02 0.00 0.01 0.02 0.00 -0.00 -0.00 0.01 0.01 -0.02 0.00 0.01 0.01 -0.00 -0.01 -0.01 -0.00 0.01 -0.01 0.00 0.04 -0.03 0.01 -0.03 0.03 0.02 0.06 -0.02 -0.03 -0.01 0.05 -0.02 0.00 0.03 0.02 -0.11 0.17 0.07 -0.03 0.02 0.05 -0.05 0.06 0.05 -0.21 -0.02 0.27 0.16 -0.01 0.24 -0.05 0.01 0.06 -0.08 0.03 -0.20 0.29 -0.05 -0.19 0.01 0.00 -0.03 0.01 -0.01 -0.02 -0.02 0.02 -0.03 -0.02 0.00 -0.03 0.01 -0.02 -0.01 0.01 -0.02 -0.03 -0.04 0.04 -0.02 0.04 -0.05 -0.10 -0.01 0.03 -0.09 -0.07 -0.01 0.02 -0.04 0.02 -0.21 0.01 -0.03 0.22 -0.02 -0.06 -0.13 -0.12 -0.06 0.02 -0.02 0.09 0.04 0.08 -0.01 0.09 0.04 0.04 -0.05 0.08 0.04 -0.03 -0.03 0.06 0.17 0.01 -0.02 -0.01 -0.09 0.02 -0.13 0.09 -0.01 0.05 -0.01 -0.05 -0.05 0.09 0.06 0.08 -0.03 0.03 -0.03 -0.08 0.03 0.00 0.08 -0.10 -0.02 -0.08 -0.11 -0.00 0.03 0.01 -0.01 -0.02 0.02 0.01 -0.05 -0.07 0.00 0.06 0.07 -0.01 -0.08 0.10 0.01 0.01 -0.04 0.02 -0.01 0.05 0.01 0.05 -0.04 -0.03 0.01 0.08 -0.04 0.03 -0.01 0.02 -0.10 0.12 0.09 0.02 -0.09 0.07 0.03 -0.13 0.03 0.04 -0.13 0.05 -0.05 -0.15 0.00 0.27 -0.04 -0.53 0.16 -0.06 0.07 0.06 -0.03 0.05 -0.09 -0.04 0.12 -0.11 0.04 0.07 0.13 -0.10 0.06 0.10 -0.01 0.04 -0.07 0.09 0.08 0.02 -0.06 -0.00 -0.01 0.03 0.01 0.03 -0.02 -0.07 -0.01 0.08 -0.06 -0.05 -0.06 0.05 -0.00 -0.01 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 0.01 0.01 -0.01 0.00 0.01 -0.00 0.03 0.01 0.00 0.00 0.00 0.00 -0.01 -0.01 0.00 -0.01 -0.01 0.01 -0.01 -0.01 0.00 -0.01 0.01 -0.00 -0.01 0.01 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.02 -0.00 -0.01 0.01 0.00 -0.00 0.02 0.05 0.01 0.13 -0.01 -0.00 -0.03 -0.00 0.00 -0.03 0.00 0.00 0.02 -0.02 -0.01 -0.10 -0.03 -0.02 -0.10 0.05 0.03 0.15 0.04 0.02 0.16 -0.04 -0.01 -0.11 -0.01 0.02 0.01 0.00 -0.01 -0.00 -0.01 0.00 0.00 -0.01 -0.02 0.01 -0.02 -0.02 0.01 0.01 0.01 -0.03 -0.00 0.03 -0.01 -0.01 0.03 -0.01 0.01 -0.00 0.10 0.01 0.00 0.09 0.01 -0.00 0.01 0.01 -0.01 0.00 0.02 0.00 0.10 -0.15 -0.07 -0.50 -0.16 -0.07 -0.48 -0.01 -0.02 -0.04 -0.01 -0.02 -0.03 -0.17 -0.07 -0.52 -0.00 -0.02 0.01 -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 -0.00 -0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.01 -0.01 0.00 -0.01 -0.00 0.00 -0.01 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 -0.11 0.02 0.00 0.08 0.01 -0.00 0.09 -0.01 -0.00 -0.02 -0.02 0.00 -0.15 -0.03 -0.00 -0.15 0.02 -0.01 0.10 0.00 0.00 0.02 0.00 0.00 0.02 -0.01 -0.00 -0.02 -0.01 -0.00 -0.03 0.01 0.00 0.02 -0.00 0.01 0.01 0.00 -0.00 0.01 0.01 -0.02 0.00 0.01 0.01 -0.00 0.00 0.00 0.00 -0.01 0.03 0.01 0.00 0.01 -0.00 -0.01 -0.00 -0.00 0.09 0.01 0.53 0.08 -0.00 0.50 0.01 0.00 0.08 0.00 0.00 0.06 0.10 -0.00 0.56 0.02 0.01 0.08 0.03 0.01 0.08 0.00 0.01 0.01 0.00 0.00 0.00 0.03 0.01 0.08 0.07 0.12 0.09 0.02 0.09 -0.00 -0.06 -0.18 -0.04 0.03 0.01 -0.01 -0.05 0.02 -0.12 0.01 0.03 0.09 0.06 -0.03 0.29 0.01 -0.05 0.01 0.02 -0.09 -0.01 -0.02 0.05 0.06 -0.00 0.06 -0.19 -0.07 0.04 -0.04 0.02 0.04 -0.05 -0.08 -0.04 -0.01 0.02 -0.04 -0.00 0.01 0.07 -0.02 0.03 -0.03 -0.00 -0.02 -0.04 -0.01 0.02 0.00 -0.01 0.02 -0.03 -0.00 -0.01 -0.04 -0.01 0.02 0.02 -0.02 -0.03 0.03 -0.01 0.03 0.01 -0.01 -0.01 -0.02 0.01 0.02 0.01 -0.01 -0.02 -0.03 0.01 -0.02 0.03 0.00 0.10 -0.26 -0.21 -0.01 -0.02 -0.22 -0.27 0.48 -0.02 -0.12 0.01 -0.06 0.02 0.03 -0.05 0.12 -0.03 -0.20 -0.14 -0.16 0.06 0.03 -0.18 0.05 -0.01 -0.02 0.12 -0.01 0.01 0.09 0.07 -0.05 0.10 0.06 -0.01 0.09 0.00 0.03 0.14 0.00 0.03 -0.01 -0.01 0.01 0.00 0.02 -0.03 -0.01 0.01 -0.05 0.00 -0.01 0.03 -0.00 0.01 -0.05 0.02 -0.09 -0.01 0.02 0.02 -0.03 -0.07 0.12 0.08 0.00 -0.06 0.07 0.01 0.01 0.02 0.00 0.10 0.06 -0.03 -0.04 0.05 -0.01 0.32 0.00 -0.01 0.00 0.05 0.00 -0.14 -0.02 0.02 -0.06 -0.09 0.00 -0.08 -0.05 0.07 -0.05 0.00 -0.07 -0.07 0.04 0.04 0.05 -0.12 0.03 0.02 -0.03 -0.02 -0.02 -0.05 0.01 0.02 0.01 0.01 0.01 -0.02 0.01 -0.01 -0.05 0.00 0.03 0.02 0.00 -0.03 0.03 0.01 -0.01 0.00 -0.01 -0.03 -0.04 -0.00 -0.01 0.02 -0.03 -0.02 -0.05 -0.01 -0.02 0.03 -0.01 -0.06 0.09 0.02 0.02 -0.07 -0.03 -0.06 0.06 0.02 -0.01 0.12 -0.04 -0.08 0.12 0.02 0.08 0.03 -0.21 -0.09 0.41 -0.17 -0.16 0.39 -0.15 -0.03 -0.02 -0.01 -0.03 0.01 -0.07 0.04 -0.06 -0.06 0.02 -0.01 -0.09 -0.03 0.04 -0.07 0.01 0.05 0.16 0.02 -0.02 0.16 0.05 0.03 0.17 0.08 -0.05 0.17 0.09 0.08 0.21 0.02 -0.17 0.20 0.03 -0.07 -0.08 0.03 0.01 -0.06 0.02 0.02 0.00 0.03 0.14 -0.03 0.11 0.17 -0.04 0.04 0.00 -0.00 0.03 -0.11 0.04 -0.15 0.26 -0.05 0.04 -0.08 -0.01 -0.14 -0.08 0.10 -0.02 0.08 -0.00 -0.02 0.07 -0.05 -0.03 -0.05 0.03 -0.02 -0.06 0.01 -0.00 0.11 -0.03 0.03 -0.03 0.00 -0.03 -0.09 -0.00 -0.01 -0.01 -0.00 0.02 -0.03 -0.00 0.01 -0.09 0.01 -0.00 0.03 0.02 -0.02 0.03 -0.00 0.03 0.01 -0.01 -0.01 -0.03 0.01 0.03 0.01 -0.01 -0.02 -0.04 0.01 -0.02 0.03 0.00 -0.09 0.03 0.05 0.05 -0.23 0.04 0.01 -0.16 0.03 -0.05 0.12 -0.03 -0.06 0.09 -0.03 0.23 0.21 -0.48 -0.05 -0.20 0.09 -0.03 -0.23 0.06 -0.05 -0.07 -0.05 -0.10 0.01 -0.06 0.10 -0.12 -0.05 -0.01 0.02 -0.05 0.01 0.09 -0.09 0.01 0.02 -0.01 -0.02 0.01 -0.00 0.03 -0.04 -0.02 0.01 -0.06 -0.01 -0.01 0.03 -0.02 -0.00 -0.01 0.10 0.03 -0.00 -0.03 -0.04 -0.01 0.01 -0.01 -0.03 -0.02 -0.03 0.05 -0.03 0.04 0.07 -0.03 -0.03 -0.03 0.06 -0.03 0.18 -0.06 -0.12 0.05 -0.01 0.03 -0.08 -0.01 0.10 -0.02 -0.03 0.00 -0.08 -0.02 0.02 -0.06 0.06 0.01 0.06 -0.07 0.03 0.08 0.00 0.02 -0.16 0.06 0.02 -0.01 0.10 -0.02 -0.03 -0.05 -0.01 -0.01 -0.05 0.00 0.04 0.07 0.00 -0.03 -0.00 -0.00 0.01 -0.00 -0.02 0.01 -0.06 -0.06 -0.01 -0.01 0.01 0.03 -0.05 -0.06 -0.00 0.01 0.03 0.05 -0.03 0.01 -0.05 -0.04 0.12 -0.15 -0.05 0.02 0.01 -0.04 0.05 -0.05 -0.03 0.04 -0.32 0.07 0.07 -0.26 0.10 0.08 0.04 -0.11 -0.02 0.15 -0.08 0.02 0.18 -0.04 -0.01 -0.03 0.06 -0.02 0.00 0.07 0.09 -0.04 0.27 0.05 0.01 0.28 0.07 0.03 0.30 -0.00 -0.02 0.06 0.05 0.01 0.07 0.01 0.10 0.21 0.05 0.12 0.21 0.10 -0.00 0.25 -0.09 0.02 -0.02 -0.01 -0.02 0.02 -0.08 0.03 0.01 0.03 0.05 -0.00 -0.09 0.01 0.04 -0.01 -0.02 -0.04 0.06 0.05 -0.07 0.05 -0.08 0.03 0.03 0.03 0.02 0.00 0.03 -0.01 0.29 -0.11 -0.04 -0.02 0.04 0.05 -0.04 0.01 -0.05 -0.02 -0.02 0.06 -0.04 -0.05 -0.03 -0.03 0.08 -0.03 0.02 -0.00 0.09 -0.01 -0.01 -0.04 -0.00 0.00 -0.05 0.05 -0.02 0.09 -0.00 -0.00 -0.00 0.01 0.00 -0.01 -0.01 0.01 -0.06 0.04 0.00 -0.06 -0.04 -0.06 -0.02 0.06 0.01 -0.03 -0.04 -0.07 0.01 -0.05 0.04 -0.06 -0.14 0.16 0.06 0.02 -0.13 0.03 -0.03 -0.04 0.03 -0.06 0.20 -0.03 -0.10 0.17 -0.07 -0.03 -0.06 0.11 0.03 -0.01 0.03 -0.02 -0.04 -0.01 0.00 -0.01 0.04 0.02 0.00 0.08 0.05 -0.01 0.25 0.06 -0.01 0.26 0.04 0.00 0.29 0.04 0.05 0.07 -0.00 0.02 0.10 0.15 -0.04 0.27 0.13 -0.07 0.30 0.09 0.11 0.34 0.01 0.01 -0.00 0.01 0.00 -0.00 0.00 -0.01 0.00 -0.01 -0.01 -0.02 0.02 -0.01 -0.01 -0.01 -0.01 0.04 -0.01 -0.01 0.02 0.01 0.01 -0.00 -0.06 -0.00 0.00 -0.00 -0.01 0.00 -0.02 0.01 -0.00 0.00 0.01 0.01 0.01 -0.00 -0.02 0.00 0.02 0.02 0.01 0.00 -0.02 -0.02 -0.00 0.00 -0.02 0.00 -0.12 0.01 0.01 0.05 0.01 0.00 0.05 0.04 0.02 0.13 0.00 0.00 0.01 0.00 -0.00 0.00 0.01 -0.00 0.07 -0.00 -0.00 -0.05 -0.02 -0.01 -0.05 0.00 -0.00 -0.02 -0.01 -0.01 -0.01 -0.03 -0.01 -0.08 0.02 -0.03 -0.01 -0.00 0.01 -0.00 0.00 0.01 -0.00 -0.02 -0.06 0.03 -0.00 -0.06 0.00 -0.01 0.02 -0.00 0.02 -0.04 0.02 0.04 -0.05 0.01 -0.01 0.01 -0.07 -0.00 0.00 -0.05 -0.07 0.00 -0.33 -0.05 -0.01 -0.30 -0.07 -0.00 -0.37 0.04 0.02 0.08 0.03 0.02 0.11 0.12 0.04 0.37 0.11 0.06 0.38 0.14 0.08 0.45 -0.06 0.01 0.05 0.00 -0.01 -0.00 -0.08 0.00 -0.00 0.01 0.01 0.01 -0.08 0.05 0.00 0.00 0.04 0.04 0.02 0.01 0.01 -0.02 0.04 -0.01 -0.01 0.04 -0.00 0.02 -0.03 -0.01 0.26 -0.09 -0.06 -0.00 -0.02 -0.01 -0.01 -0.02 0.03 -0.01 0.00 -0.03 -0.01 0.01 0.02 0.02 -0.03 0.01 -0.01 -0.01 -0.14 -0.00 -0.04 0.06 0.03 0.01 0.05 -0.03 -0.01 -0.09 -0.01 -0.04 0.01 0.03 0.01 0.00 -0.00 0.02 0.09 -0.00 0.00 0.04 0.01 0.01 0.03 -0.01 0.00 0.01 0.01 0.01 0.01 0.02 0.00 0.05 0.00 -0.02 -0.00 0.02 -0.06 -0.02 0.00 -0.03 -0.00 0.01 -0.03 -0.00 0.01 0.02 0.01 0.03 0.04 -0.09 -0.03 0.06 -0.03 -0.03 0.11 -0.03 -0.03 -0.02 -0.09 -0.01 0.01 -0.04 -0.02 -0.05 -0.41 -0.03 -0.02 -0.37 -0.09 0.03 -0.46 -0.03 -0.01 -0.04 -0.02 -0.02 -0.07 -0.09 -0.02 -0.24 -0.09 -0.03 -0.26 -0.09 -0.05 -0.31 0.02 0.03 0.00 0.05 0.00 0.01 0.01 -0.02 -0.00 0.07 0.19 0.02 0.06 -0.06 -0.02 0.00 -0.05 0.01 0.03 0.01 0.03 0.08 0.17 -0.05 -0.21 0.03 0.02 0.03 -0.04 -0.01 -0.05 0.03 -0.01 -0.03 -0.02 0.12 -0.04 -0.11 -0.10 -0.01 0.04 0.07 -0.02 -0.04 -0.10 -0.07 -0.10 0.04 -0.01 0.00 -0.01 0.01 0.04 -0.00 -0.02 -0.01 0.00 -0.00 -0.04 -0.07 0.00 0.04 -0.00 -0.02 -0.01 0.01 0.02 -0.02 0.00 0.08 -0.00 -0.02 -0.07 -0.10 0.06 0.12 0.01 -0.04 -0.06 -0.14 0.05 -0.03 0.10 0.04 -0.00 -0.03 -0.01 0.03 -0.09 -0.02 -0.01 -0.02 -0.00 -0.12 -0.04 0.07 -0.14 0.01 -0.08 -0.02 -0.06 0.08 0.11 0.38 -0.10 0.10 0.41 -0.20 0.02 0.02 0.01 -0.01 -0.01 0.01 -0.05 0.06 -0.00 -0.04 0.02 -0.01 -0.00 -0.03 -0.02 0.04 0.05 0.07 -0.09 -0.08 0.02 0.10 -0.15 -0.12 0.04 -0.27 -0.16 -0.08 0.07 -0.21 -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 0.00 0.03 -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 -0.00 0.01 -0.00 -0.00 0.00 0.02 -0.01 0.00 -0.02 0.01 0.00 0.02 -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 0.01 -0.02 0.01 -0.09 -0.00 -0.01 0.08 0.00 0.00 0.00 -0.00 0.01 -0.05 -0.01 -0.00 0.06 0.01 -0.00 0.01 -0.00 -0.00 -0.02 0.01 0.00 0.02 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.01 -0.01 -0.00 -0.01 0.02 0.00 0.01 -0.00 -0.00 0.00 -0.11 0.03 0.01 0.11 -0.04 0.04 -0.01 -0.01 -0.00 -0.12 0.04 0.02 0.12 -0.04 0.09 0.01 0.54 -0.10 -0.01 -0.52 0.05 0.02 0.35 -0.10 0.02 -0.39 0.00 0.00 -0.06 0.04 0.02 0.10 -0.04 -0.03 -0.11 0.03 0.01 0.09 -0.03 -0.01 -0.07 0.00 0.00 0.02 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 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 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.01 -0.00 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 0.00 -0.00 0.00 -0.02 0.00 -0.00 0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 0.00 0.02 0.01 0.07 -0.02 -0.01 -0.07 0.02 0.01 0.06 -0.02 -0.01 -0.06 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 0.09 -0.03 -0.00 -0.06 0.02 -0.01 -0.00 0.02 0.01 0.10 -0.03 -0.01 -0.08 0.02 0.03 0.01 0.15 -0.02 -0.00 -0.14 0.01 0.00 0.09 -0.02 0.01 -0.10 -0.00 -0.00 -0.02 -0.15 -0.08 -0.49 0.16 0.08 0.51 -0.12 -0.06 -0.39 0.11 0.06 0.37 -0.00 -0.00 -0.02 0.00 0.01 0.00 0.01 -0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.00 -0.01 -0.00 0.01 -0.02 0.00 0.02 0.01 -0.00 0.00 0.01 -0.01 -0.02 0.01 0.01 0.01 -0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.07 0.02 -0.00 0.05 -0.01 -0.01 -0.07 0.02 -0.00 0.07 -0.01 0.00 0.00 -0.01 0.00 -0.00 0.00 -0.00 0.01 -0.02 -0.01 -0.00 0.01 0.00 0.00 0.00 0.00 0.02 -0.01 -0.01 -0.00 0.02 0.01 -0.00 0.01 -0.01 -0.00 -0.02 0.01 0.01 0.01 -0.01 -0.00 -0.01 0.01 0.01 0.01 0.00 -0.00 0.00 -0.03 0.02 -0.00 0.02 -0.06 -0.01 -0.03 0.01 0.01 0.02 0.44 -0.14 -0.01 -0.37 0.13 0.01 -0.03 -0.00 0.02 0.48 -0.16 -0.05 -0.47 0.16 0.02 0.01 0.12 -0.02 -0.00 -0.08 -0.00 0.02 0.06 -0.03 0.01 -0.09 -0.00 -0.01 -0.04 0.04 0.02 0.13 -0.03 -0.01 -0.12 0.02 0.02 0.09 -0.04 -0.01 -0.10 -0.00 -0.00 -0.01 0.01 0.06 0.01 0.02 -0.02 0.02 -0.02 -0.05 -0.04 0.06 -0.06 -0.00 0.01 -0.06 0.00 0.08 -0.14 0.01 0.19 0.10 -0.03 0.03 -0.02 0.01 -0.10 0.08 0.03 0.07 0.02 -0.01 -0.02 -0.03 -0.02 -0.04 0.01 -0.04 -0.04 0.00 0.04 -0.05 0.02 -0.07 -0.06 0.01 0.06 0.05 -0.01 0.00 0.01 -0.01 -0.01 0.02 0.07 0.00 -0.07 -0.04 0.00 0.01 -0.01 0.00 0.01 0.12 0.01 -0.11 -0.03 0.01 0.04 -0.03 0.00 -0.04 -0.00 0.02 0.03 0.03 -0.02 -0.07 0.01 0.02 0.03 0.06 -0.02 0.02 -0.03 -0.00 -0.30 0.22 0.05 0.12 -0.51 -0.07 -0.20 0.04 0.06 -0.05 -0.18 0.02 -0.05 0.11 0.02 0.12 -0.20 -0.06 -0.16 -0.21 0.06 -0.15 0.09 -0.02 0.03 0.05 -0.02 -0.06 -0.04 0.09 -0.11 0.15 -0.04 -0.14 0.08 0.05 0.02 -0.04 -0.06 -0.05 -0.01 -0.00 0.04 0.03 0.01 -0.08 0.08 -0.00 -0.03 0.10 0.01 0.02 -0.02 0.00 -0.01 -0.03 -0.02 -0.02 0.01 -0.01 -0.00 0.02 0.01 -0.03 0.02 0.00 -0.09 0.05 0.02 0.23 0.00 0.01 -0.09 -0.05 0.02 -0.01 0.01 -0.00 0.08 -0.06 -0.02 -0.04 -0.00 0.01 0.03 0.01 -0.00 0.02 -0.00 0.01 0.02 -0.00 -0.01 0.02 -0.01 0.03 0.03 -0.01 -0.02 -0.02 0.01 -0.00 0.03 -0.01 -0.01 -0.00 0.05 0.01 -0.14 -0.09 -0.01 -0.00 0.00 0.00 0.03 0.12 0.02 -0.18 -0.03 0.02 0.07 -0.03 0.00 0.02 0.00 0.00 -0.01 -0.02 -0.00 0.03 -0.00 -0.01 -0.01 -0.02 0.00 -0.01 0.01 -0.00 0.16 -0.12 -0.03 -0.06 0.26 0.02 0.08 0.01 -0.03 0.03 0.06 -0.00 0.03 -0.01 -0.02 0.43 -0.11 -0.49 0.07 0.06 -0.02 0.07 0.00 -0.00 0.00 0.02 -0.08 -0.12 -0.09 0.20 -0.09 0.14 -0.12 -0.24 0.17 0.12 0.09 0.01 -0.11 0.00 -0.00 -0.05 0.00 -0.00 0.05 0.03 -0.04 -0.03 0.02 -0.03 0.04 -0.01 0.01 0.02 0.01 0.02 0.03 0.01 0.00 0.00 -0.00 -0.02 -0.01 -0.12 -0.04 0.01 0.01 -0.01 -0.01 -0.01 -0.01 0.00 0.01 0.02 0.00 -0.03 0.08 -0.03 -0.03 0.01 0.01 0.02 -0.03 -0.01 -0.02 0.00 -0.01 0.04 -0.10 -0.05 0.04 -0.04 0.10 0.00 -0.08 -0.02 0.01 -0.08 0.09 0.00 0.16 -0.06 -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 0.01 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.03 0.02 0.00 0.01 0.00 0.02 0.03 -0.01 -0.01 -0.01 -0.01 -0.00 -0.01 -0.00 -0.02 0.01 -0.02 -0.00 0.02 -0.04 -0.01 0.01 -0.04 -0.01 0.12 0.40 -0.18 0.12 0.47 -0.10 -0.01 -0.02 0.02 0.00 0.30 -0.14 0.04 0.50 -0.11 -0.00 0.00 -0.03 -0.00 0.00 0.00 -0.01 0.01 -0.01 0.00 -0.00 0.02 0.00 -0.01 0.03 0.00 -0.01 -0.13 -0.03 0.00 -0.12 0.05 -0.05 0.03 0.01 0.00 0.05 0.01 0.01 0.15 0.00 -0.02 -0.00 0.00 0.01 -0.00 0.00 0.01 0.01 0.19 -0.15 0.00 -0.00 0.01 -0.00 0.01 0.03 0.00 -0.04 -0.02 0.01 0.03 0.07 -0.02 -0.01 -0.03 -0.00 -0.01 -0.02 0.00 0.00 0.01 0.00 -0.09 0.01 0.17 -0.08 -0.10 -0.14 -0.02 -0.01 0.14 -0.01 -0.10 -0.10 0.05 0.10 -0.04 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.04 -0.06 0.01 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.08 -0.01 0.02 0.06 0.07 -0.03 -0.16 0.03 0.04 0.06 0.13 -0.03 0.02 -0.04 0.00 0.11 -0.09 -0.02 -0.03 0.16 0.02 0.06 -0.01 -0.02 -0.20 0.34 0.00 -0.18 0.28 -0.21 0.02 0.03 -0.03 0.03 0.34 0.02 0.06 0.26 -0.21 -0.01 -0.00 -0.01 -0.00 -0.00 -0.03 0.01 -0.01 -0.00 0.00 0.01 0.00 0.01 0.01 0.01 -0.08 0.00 0.08 0.07 0.09 -0.02 -0.16 0.17 0.04 -0.07 0.20 -0.04 0.03 -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 -0.01 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 -0.01 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 -0.00 0.01 0.00 0.08 -0.02 -0.01 -0.10 -0.01 0.01 -0.11 -0.00 -0.00 -0.00 0.00 -0.01 0.02 0.01 0.00 0.00 0.02 -0.00 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 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.03 -0.01 0.04 0.00 -0.01 0.00 0.00 0.04 -0.01 0.08 0.00 0.52 0.10 0.01 0.58 -0.01 -0.01 -0.09 0.02 -0.01 -0.02 -0.10 -0.00 -0.55 -0.01 -0.00 -0.02 -0.01 -0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 0.01 0.01 0.00 0.02 0.00 0.00 0.01 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 0.01 -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 0.01 -0.00 0.02 0.00 -0.01 -0.01 0.00 -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 0.02 0.01 0.08 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.02 -0.01 -0.10 -0.03 -0.01 -0.10 0.01 -0.00 0.00 0.00 0.00 0.01 0.03 0.01 0.09 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.01 -0.00 0.02 0.04 -0.02 0.02 0.06 -0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.01 0.05 -0.00 0.00 0.00 0.02 0.01 -0.00 0.01 -0.00 -0.00 -0.01 -0.00 0.02 0.01 -0.01 -0.00 -0.03 0.18 0.09 0.53 0.18 0.10 0.54 -0.00 -0.01 -0.03 -0.02 -0.01 -0.06 -0.16 -0.08 -0.51 0.09 0.13 0.22 -0.01 0.01 0.05 -0.02 -0.09 -0.02 0.01 0.01 0.00 -0.02 -0.01 -0.08 -0.01 -0.04 0.03 -0.10 0.02 -0.16 -0.03 -0.03 0.01 0.06 -0.01 0.03 -0.03 -0.04 -0.14 -0.02 0.03 -0.07 0.00 0.00 0.02 -0.00 -0.01 -0.01 0.02 0.03 0.03 0.01 0.02 -0.04 -0.01 -0.02 0.01 0.01 -0.01 -0.00 0.01 0.01 -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 -0.05 0.32 0.22 -0.05 0.16 0.28 0.34 -0.63 -0.04 0.02 0.07 0.01 -0.00 0.06 -0.04 0.01 -0.08 0.02 0.04 -0.11 0.06 0.02 -0.16 0.03 0.01 0.01 0.01 -0.01 -0.00 -0.01 -0.02 0.02 -0.01 -0.01 -0.00 0.02 -0.01 -0.01 0.01 -0.00 -0.00 -0.01 -0.01 -0.00 -0.01 -0.00 0.00 -0.00 0.00 -0.01 -0.00 0.01 0.01 0.01 -0.00 -0.01 -0.02 0.00 -0.00 -0.01 0.00 0.01 -0.00 0.01 0.01 -0.00 0.00 0.00 0.01 -0.00 0.00 -0.00 0.00 0.01 0.02 -0.01 0.03 -0.01 -0.01 0.01 -0.00 0.01 -0.01 0.01 -0.00 -0.01 0.01 -0.00 -0.10 0.03 -0.00 -0.05 0.01 0.00 0.10 -0.03 0.01 0.04 -0.03 -0.01 -0.04 0.02 -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 0.01 -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 -0.01 0.00 0.00 0.00 -0.00 0.04 -0.07 -0.03 0.01 0.00 -0.03 -0.02 0.06 -0.00 0.03 0.59 -0.18 -0.01 0.33 -0.10 -0.00 0.00 0.00 -0.06 -0.56 0.21 -0.01 -0.28 0.08 0.00 -0.00 0.03 -0.00 0.00 -0.02 -0.01 -0.00 -0.05 0.01 -0.00 0.04 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.01 -0.01 -0.01 0.00 0.00 -0.01 0.01 -0.01 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 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -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 0.01 0.00 0.08 -0.01 0.00 -0.06 0.00 0.00 0.00 -0.02 0.00 -0.11 0.01 0.00 0.08 0.00 -0.00 0.02 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -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 -0.00 -0.01 0.00 0.01 -0.00 -0.01 -0.01 -0.06 0.02 0.00 0.01 -0.01 -0.07 -0.01 -0.41 0.05 0.00 0.35 0.10 0.00 0.66 -0.08 0.00 -0.44 -0.02 -0.00 -0.13 0.00 0.00 0.02 0.00 -0.01 0.00 -0.01 -0.00 -0.02 -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 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 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 -0.07 0.03 0.01 0.07 0.03 0.01 0.09 -0.03 -0.02 -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 0.01 -0.00 -0.00 -0.03 0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.02 -0.00 0.00 -0.00 0.01 -0.01 0.00 -0.01 0.00 0.00 -0.02 0.01 -0.02 0.01 0.00 0.01 0.01 0.12 0.06 0.41 -0.12 -0.06 -0.39 -0.16 -0.08 -0.52 0.15 0.09 0.52 -0.01 0.00 -0.02 -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 0.01 -0.00 -0.00 -0.00 -0.00 0.01 0.01 0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.01 -0.00 -0.00 0.00 0.00 0.06 -0.03 -0.00 -0.11 0.04 -0.00 -0.05 0.02 0.01 0.09 -0.03 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 -0.00 -0.00 -0.01 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 -0.00 -0.00 -0.00 0.03 -0.04 -0.02 -0.00 0.01 -0.02 0.00 0.02 -0.01 -0.02 -0.32 0.08 0.01 0.64 -0.20 -0.01 0.00 0.00 0.02 0.29 -0.09 -0.04 -0.50 0.17 -0.01 -0.00 -0.04 0.00 0.00 0.00 0.01 0.00 0.08 0.01 -0.00 0.05 -0.01 -0.00 -0.08 0.01 0.00 0.02 -0.01 0.00 -0.01 -0.01 -0.01 -0.04 -0.00 -0.01 -0.01 0.01 0.00 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 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -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 0.01 -0.00 -0.00 -0.01 -0.01 -0.00 -0.03 -0.01 -0.00 -0.03 0.02 0.01 0.08 0.03 0.01 0.07 -0.03 -0.02 -0.09 -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 -0.02 0.01 -0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.02 -0.01 0.00 0.01 0.02 0.01 0.00 0.03 -0.01 -0.00 -0.05 -0.02 0.02 -0.06 0.01 -0.00 0.06 0.08 0.04 0.22 0.07 0.03 0.22 -0.16 -0.08 -0.49 -0.14 -0.09 -0.49 0.16 0.08 0.53 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 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 0.01 -0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.01 0.02 0.01 0.01 0.04 -0.00 -0.00 -0.00 -0.01 0.01 -0.06 -0.02 -0.00 -0.10 0.02 -0.00 0.09 -0.00 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 0.01 0.00 0.00 0.01 -0.01 0.00 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.03 -0.01 0.00 -0.08 0.03 0.00 -0.00 -0.00 -0.00 -0.03 0.01 0.01 0.06 -0.02 -0.03 -0.02 -0.14 -0.02 0.01 -0.31 0.08 0.00 0.39 0.11 -0.02 0.62 -0.08 0.00 -0.52 0.01 -0.00 0.02 0.01 0.02 0.01 -0.02 -0.01 -0.05 -0.00 -0.02 -0.06 0.02 0.01 0.06 0.06 0.15 -0.03 -0.02 -0.06 -0.03 -0.03 -0.04 -0.07 -0.00 -0.00 -0.00 0.02 0.04 0.10 -0.04 -0.14 -0.01 -0.11 0.05 0.02 -0.04 -0.02 0.02 0.11 0.30 -0.02 -0.01 -0.14 0.08 -0.02 -0.12 0.03 0.00 0.01 -0.02 0.00 0.02 -0.02 0.01 0.01 0.03 0.03 -0.03 -0.04 -0.00 0.00 0.01 0.01 -0.03 0.00 0.00 -0.00 -0.00 0.01 0.04 -0.01 0.00 -0.00 0.00 0.00 0.06 0.00 -0.02 -0.02 0.01 -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 0.38 -0.59 -0.22 -0.04 0.22 -0.18 0.05 0.22 -0.07 0.01 -0.04 0.01 -0.01 -0.13 0.03 -0.11 -0.07 0.11 -0.01 0.03 0.04 0.07 0.05 -0.04 0.02 -0.04 0.01 0.01 0.04 0.01 -0.03 0.07 -0.01 -0.01 -0.06 -0.02 -0.04 -0.07 0.03 0.01 0.00 -0.00 -0.00 -0.01 0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.01 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 0.00 0.01 0.01 -0.00 -0.01 0.00 0.00 -0.00 -0.01 -0.04 -0.00 0.00 0.01 -0.01 -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 0.01 0.00 -0.01 -0.36 -0.15 0.06 0.10 0.37 -0.02 0.00 -0.00 0.00 0.03 0.07 0.01 -0.08 -0.04 0.03 0.26 -0.22 -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 0.01 0.00 -0.04 0.06 0.02 0.00 -0.02 0.02 -0.00 -0.03 0.01 -0.00 0.00 0.00 0.00 0.01 -0.01 0.03 0.03 -0.07 0.00 0.00 -0.01 -0.00 -0.00 0.00 -0.33 -0.28 0.06 0.28 0.34 -0.02 0.08 0.05 -0.07 -0.07 -0.07 -0.08 0.29 -0.22 0.03 -0.01 -0.00 -0.00 0.01 -0.02 0.00 0.00 -0.00 0.01 -0.01 0.01 0.02 -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 -0.00 0.00 0.00 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 0.01 -0.00 -0.01 0.01 0.00 0.01 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.02 0.01 -0.00 0.00 0.00 -0.00 0.01 0.00 -0.00 -0.00 -0.01 -0.00 -0.01 0.02 0.01 -0.00 -0.01 0.00 0.01 0.00 0.01 -0.00 0.00 -0.01 -0.20 -0.32 0.11 0.37 0.01 -0.13 0.07 0.00 -0.02 -0.04 -0.06 0.03 -0.18 0.32 0.00 0.01 -0.02 -0.01 -0.00 0.01 -0.01 -0.00 0.01 -0.00 0.00 -0.02 -0.01 0.01 0.02 0.01 -0.00 -0.00 0.00 0.00 0.02 -0.00 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 -0.01 0.01 -0.01 -0.00 -0.01 -0.01 0.03 -0.05 0.00 -0.00 0.03 -0.29 -0.29 0.13 0.41 0.14 -0.09 0.05 0.03 -0.02 -0.06 -0.05 -0.03 -0.17 0.34 0.03 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.00 0.00 0.00 -0.00 -0.04 0.00 -0.00 -0.00 -0.02 0.00 0.03 0.01 0.00 -0.00 -0.00 0.00 0.02 -0.05 -0.16 0.02 0.06 0.17 0.03 0.06 0.20 0.03 -0.07 -0.20 -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 0.00 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 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.07 0.05 -0.00 0.04 -0.13 -0.03 -0.07 0.04 0.02 -0.22 -0.12 -0.29 -0.23 0.06 0.32 0.01 0.01 -0.01 -0.29 0.17 0.37 -0.29 -0.08 -0.41 -0.01 0.01 0.00 0.01 -0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.01 -0.00 0.01 0.01 -0.00 0.02 -0.01 -0.01 -0.01 -0.01 -0.00 -0.01 -0.01 0.01 0.02 -0.01 -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 0.01 -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 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.00 -0.00 -0.01 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 0.00 -0.01 -0.00 0.00 -0.01 0.00 0.00 -0.01 -0.02 0.00 0.01 0.01 -0.00 0.02 -0.01 -0.00 -0.07 0.03 0.02 0.03 0.08 -0.02 0.15 0.06 -0.06 -0.12 -0.09 0.06 0.07 -0.14 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 -0.01 -0.01 0.01 0.00 -0.02 -0.00 -0.00 -0.01 -0.01 0.01 0.00 -0.00 -0.00 -0.01 0.01 0.02 -0.02 0.01 -0.02 -0.02 0.05 0.00 -0.04 0.01 -0.00 -0.05 -0.01 0.01 -0.00 0.07 0.01 0.02 -0.01 -0.01 -0.44 0.25 0.10 0.02 0.42 -0.07 0.16 0.40 -0.11 -0.45 0.09 0.10 0.05 -0.16 0.02 -0.01 -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 -0.01 -0.02 0.01 0.00 0.00 -0.00 0.01 -0.00 0.00 -0.00 -0.00 -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 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.01 -0.01 -0.00 0.02 -0.08 -0.01 0.08 0.00 -0.02 -0.00 0.00 0.00 0.10 0.15 -0.02 -0.12 -0.12 0.03 -0.13 0.10 0.02 -0.01 0.00 0.00 0.01 0.01 -0.01 0.02 0.01 -0.01 -0.02 -0.01 0.01 0.00 -0.02 -0.00 -0.02 0.03 0.01 0.00 -0.01 0.02 0.00 -0.02 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.03 0.03 0.01 -0.01 0.00 0.01 -0.01 0.00 -0.01 0.15 -0.43 -0.01 0.38 -0.06 -0.03 0.47 0.09 -0.09 -0.01 -0.49 -0.04 -0.17 0.08 0.05 -0.07 0.04 0.01 0.02 0.04 0.02 0.02 0.05 -0.01 -0.07 0.02 -0.00 -0.00 -0.02 0.01 -0.05 -0.09 -0.03 -0.00 -0.01 -0.02 0.01 0.01 0.02 0.00 0.00 -0.00 0.01 0.04 -0.01 -0.01 -0.07 0.01 0.06 0.07 0.17 0.10 -0.00 0.04 0.01 0.06 -0.02 -0.08 -0.05 -0.09 0.02 0.09 -0.05 0.03 -0.02 -0.04 -0.01 0.00 -0.00 -0.07 -0.01 -0.03 -0.00 -0.00 -0.01 0.01 0.01 0.02 0.00 -0.04 0.00 0.04 -0.01 -0.01 -0.02 0.04 0.00 0.00 -0.02 0.00 -0.01 0.04 0.00 0.03 0.01 -0.01 -0.01 -0.04 0.00 -0.00 0.02 -0.00 0.02 -0.01 -0.00 0.01 -0.00 -0.00 0.01 0.02 -0.00 -0.01 -0.01 0.01 0.19 0.09 0.16 -0.11 0.33 0.26 0.32 -0.40 -0.07 0.05 -0.00 -0.05 -0.17 0.01 0.10 -0.04 -0.04 0.06 -0.34 0.06 0.11 0.01 0.00 0.01 0.07 -0.09 -0.00 -0.18 0.08 0.03 -0.14 0.07 0.02 0.04 -0.02 0.00 -0.14 -0.19 0.02 -0.08 0.06 0.02 0.02 -0.07 0.01 0.01 -0.03 0.00 -0.03 0.04 0.00 -0.08 -0.04 0.03 0.00 0.06 0.02 0.01 -0.00 0.02 -0.00 -0.01 -0.01 0.01 0.00 0.00 0.01 -0.02 0.01 0.01 0.03 -0.00 0.12 -0.13 -0.14 0.20 -0.00 -0.02 -0.06 0.00 0.01 -0.15 0.02 0.06 -0.01 -0.04 0.02 0.01 -0.02 -0.03 0.02 0.01 0.05 -0.05 -0.01 -0.04 -0.09 0.02 0.05 -0.00 -0.00 -0.01 -0.00 0.02 -0.00 -0.02 0.00 0.00 0.01 -0.02 -0.00 0.01 -0.01 -0.00 0.01 -0.02 -0.00 -0.01 -0.01 0.00 0.01 0.02 -0.00 0.00 -0.01 0.00 -0.01 0.01 0.00 -0.01 0.01 0.00 -0.00 -0.00 0.00 0.01 0.00 -0.00 0.27 -0.20 -0.01 -0.20 0.63 0.02 0.16 0.16 -0.08 -0.20 -0.01 -0.16 -0.11 0.06 0.12 0.02 0.01 -0.03 -0.12 -0.00 0.00 -0.30 0.00 -0.07 -0.04 0.04 0.00 0.08 -0.04 -0.02 0.08 -0.03 -0.01 -0.02 -0.00 -0.00 0.07 0.09 -0.01 0.03 -0.03 -0.00 -0.01 0.07 -0.01 -0.01 0.04 -0.00 0.01 -0.01 0.00 0.05 0.03 -0.02 -0.01 -0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 -0.02 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 -0.00 0.02 0.03 -0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 -0.01 -0.01 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 0.01 -0.00 -0.00 -0.00 0.01 -0.00 0.03 0.03 -0.01 0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.01 -0.00 0.01 -0.10 0.01 -0.08 0.07 0.01 -0.06 0.03 0.01 -0.03 -0.08 0.02 0.08 0.03 -0.03 0.01 0.02 0.02 -0.00 -0.00 0.03 0.02 -0.05 -0.00 0.02 -0.00 0.00 0.00 -0.01 -0.00 -0.01 -0.00 0.01 -0.01 0.01 -0.00 0.03 0.02 0.01 0.02 -0.03 -0.00 -0.02 0.01 0.01 -0.02 0.01 0.00 0.00 -0.01 -0.02 -0.03 -0.04 0.01 0.40 -0.34 -0.07 -0.10 0.47 -0.05 -0.07 0.29 -0.02 0.11 -0.17 -0.00 0.45 0.25 -0.18 -0.00 0.01 -0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 -0.02 0.02 -0.02 -0.02 -0.00 -0.00 0.05 0.07 0.01 0.00 0.03 0.01 0.01 -0.01 -0.00 -0.02 -0.04 -0.00 -0.01 0.00 0.02 -0.00 -0.02 -0.02 -0.00 -0.02 -0.03 -0.00 -0.02 0.02 -0.00 -0.01 0.00 0.01 0.01 0.02 0.04 -0.00 -0.09 0.04 0.02 0.05 -0.09 -0.01 0.00 -0.00 -0.00 0.00 -0.07 -0.00 -0.07 -0.02 0.01 0.05 0.07 -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 0.03 0.04 0.05 -0.01 0.01 0.07 0.08 -0.15 -0.02 0.11 -0.00 0.04 -0.12 0.00 0.04 -0.03 -0.03 0.04 -0.18 0.04 0.06 0.15 0.01 0.06 -0.21 0.37 0.02 0.39 -0.17 -0.05 0.21 -0.12 -0.03 -0.11 0.09 0.01 0.38 0.45 -0.06 0.01 -0.01 -0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.00 -0.00 -0.00 0.00 0.01 0.01 -0.01 -0.02 -0.05 0.00 -0.00 -0.01 -0.00 0.00 0.00 0.01 -0.00 0.00 0.00 0.01 0.02 -0.02 -0.02 -0.05 0.01 0.00 0.03 0.05 -0.01 -0.02 -0.04 0.02 0.05 -0.01 -0.01 -0.02 -0.01 0.01 0.06 -0.04 -0.08 0.01 0.02 0.07 0.00 0.02 0.07 0.01 0.03 -0.06 0.01 0.02 0.00 -0.01 -0.02 0.02 -0.01 -0.00 -0.02 0.01 0.00 0.02 -0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.02 -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 0.05 -0.01 0.02 -0.01 0.04 0.05 0.04 -0.06 -0.01 -0.38 -0.01 -0.16 0.39 -0.05 -0.14 -0.04 -0.05 0.06 0.48 -0.11 -0.17 -0.46 -0.04 -0.21 -0.06 0.14 0.01 0.07 -0.03 -0.01 0.01 -0.01 -0.00 -0.03 0.02 0.00 0.11 0.12 -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 0.03 0.12 0.01 -0.02 -0.02 -0.15 -0.04 -0.07 -0.14 0.00 -0.00 0.00 0.07 0.02 0.51 0.05 0.05 -0.08 0.01 -0.06 0.11 0.01 0.02 -0.00 -0.05 -0.13 -0.08 -0.00 0.05 -0.09 -0.02 -0.01 -0.09 -0.03 -0.01 -0.01 0.03 -0.00 0.00 0.02 0.00 0.00 -0.02 0.00 0.01 -0.01 0.00 -0.00 -0.05 0.04 0.01 0.02 -0.01 -0.00 -0.01 0.01 0.01 -0.00 0.00 0.00 0.01 -0.01 0.00 0.03 -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 -0.00 0.00 -0.13 0.33 0.15 0.00 -0.06 0.21 0.04 -0.28 0.02 -0.17 0.02 -0.10 0.15 -0.01 -0.07 -0.04 0.36 -0.12 0.15 -0.04 -0.07 -0.14 -0.01 -0.06 0.06 -0.14 -0.02 -0.01 0.01 -0.02 0.02 -0.02 -0.01 0.06 -0.07 -0.00 -0.08 -0.06 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 -0.01 -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 -0.00 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 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 0.02 -0.00 -0.01 -0.02 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.04 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.04 0.05 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 0.01 -0.01 -0.00 0.03 0.06 -0.02 0.01 -0.03 0.00 -0.05 -0.02 0.02 0.00 -0.00 -0.00 -0.00 0.01 -0.00 0.00 0.01 -0.00 0.04 0.01 0.04 0.04 -0.02 -0.04 -0.00 -0.00 0.00 -0.11 0.03 0.06 -0.10 -0.01 -0.07 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 -0.00 0.40 -0.23 -0.09 0.01 -0.15 0.02 0.02 0.56 -0.09 0.14 -0.11 -0.02 -0.48 -0.27 0.19 0.00 0.02 -0.02 0.00 0.01 0.00 0.00 0.00 -0.00 0.02 0.02 0.00 -0.01 -0.02 -0.02 0.00 0.02 -0.00 -0.01 0.04 0.03 0.02 -0.00 0.01 0.00 -0.01 0.00 0.00 -0.02 -0.01 -0.01 -0.03 0.03 -0.01 -0.01 -0.04 0.01 0.01 0.03 0.00 -0.00 -0.01 -0.00 0.00 0.01 -0.06 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.01 0.00 0.00 -0.00 -0.00 0.03 -0.06 -0.00 0.04 -0.01 -0.01 -0.01 0.03 0.00 -0.03 -0.03 0.00 0.00 -0.00 -0.00 0.00 0.02 -0.00 -0.03 0.01 0.01 0.04 0.00 -0.01 -0.02 -0.02 0.01 0.02 0.01 0.01 0.00 -0.00 0.03 0.03 -0.05 -0.01 -0.16 -0.03 -0.12 -0.11 0.03 0.09 0.01 0.01 -0.02 0.25 -0.07 -0.14 0.18 0.02 0.12 -0.06 0.16 0.01 0.09 -0.02 -0.01 0.36 -0.08 -0.06 -0.09 0.27 0.00 -0.28 -0.32 0.05 -0.11 0.06 0.02 -0.01 0.30 -0.06 -0.03 0.13 -0.01 0.29 -0.15 -0.05 -0.24 -0.15 0.10 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.02 -0.02 -0.00 0.00 0.01 0.01 -0.01 -0.01 0.00 0.01 -0.01 -0.01 -0.01 0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.01 0.00 0.00 0.01 -0.01 0.00 0.01 0.03 0.00 -0.01 -0.03 -0.00 0.00 0.01 -0.00 -0.00 -0.01 0.06 -0.00 -0.00 0.01 -0.01 0.00 -0.01 0.02 0.00 0.01 -0.00 -0.00 -0.03 0.05 0.00 0.05 -0.01 -0.01 -0.02 0.03 0.00 -0.03 -0.04 0.01 -0.00 0.00 -0.00 -0.00 -0.01 0.00 0.02 -0.01 -0.00 -0.03 -0.00 0.01 0.02 0.02 -0.01 -0.00 -0.00 -0.01 -0.00 0.01 -0.01 -0.00 0.02 0.00 0.11 0.02 0.09 0.11 -0.03 -0.09 -0.02 0.02 0.01 -0.20 0.06 0.12 -0.19 -0.03 -0.12 -0.09 0.27 0.01 0.09 -0.02 -0.01 0.44 -0.10 -0.07 -0.11 0.32 0.03 -0.32 -0.37 0.05 0.09 -0.05 -0.02 0.00 -0.23 0.03 0.02 -0.10 0.01 -0.20 0.11 0.05 0.17 0.10 -0.07 -0.01 -0.04 0.04 -0.00 -0.01 -0.01 -0.00 -0.01 0.01 -0.03 0.02 -0.00 0.02 0.06 0.04 -0.02 -0.05 0.01 0.02 -0.10 -0.06 -0.04 0.00 -0.02 0.00 0.04 -0.01 -0.00 0.04 0.03 0.01 0.09 -0.07 0.03 0.01 0.03 -0.01 -0.01 -0.01 -0.01 0.01 0.01 0.00 -0.01 -0.01 0.03 -0.01 -0.00 0.02 -0.03 -0.00 -0.00 0.01 0.00 0.01 -0.01 -0.00 0.02 -0.04 -0.00 0.00 0.01 -0.00 -0.02 -0.00 0.01 0.00 -0.00 -0.00 -0.02 0.01 0.00 -0.01 0.04 -0.00 -0.02 -0.02 0.01 0.05 -0.02 -0.02 -0.01 -0.01 0.01 -0.06 0.00 -0.03 0.00 -0.01 -0.05 -0.07 0.10 0.03 0.27 0.04 0.17 0.12 -0.01 -0.09 -0.07 0.01 0.06 -0.26 0.07 0.15 -0.11 -0.02 -0.08 -0.04 0.12 0.01 0.01 -0.01 0.00 -0.00 0.01 0.00 -0.03 0.03 -0.02 0.03 0.02 -0.00 -0.25 0.15 0.06 -0.02 0.46 -0.07 -0.02 -0.14 0.03 0.45 -0.26 -0.09 -0.17 -0.10 0.07 -0.01 -0.06 0.04 -0.00 -0.02 -0.01 -0.00 -0.01 0.01 0.04 -0.00 0.00 0.03 0.07 0.04 -0.04 -0.06 0.01 0.02 -0.12 -0.05 -0.02 0.01 -0.02 0.00 0.05 -0.01 -0.00 0.05 0.03 0.02 0.11 -0.09 0.00 -0.01 -0.03 -0.05 0.02 0.05 0.01 -0.00 0.00 0.04 -0.00 0.00 -0.08 0.01 -0.01 0.04 -0.05 -0.00 0.00 0.01 -0.00 0.02 -0.01 -0.00 0.01 -0.02 -0.00 0.01 0.02 -0.00 -0.02 0.00 0.00 0.00 -0.01 -0.00 0.02 -0.01 -0.00 0.01 -0.03 0.00 -0.00 0.03 -0.00 -0.03 0.02 0.01 0.00 0.00 -0.00 -0.06 0.03 -0.02 -0.00 0.01 -0.03 -0.09 0.10 0.03 -0.09 -0.01 -0.09 -0.31 0.09 0.19 -0.09 0.03 0.08 0.29 -0.07 -0.15 0.47 0.06 0.26 -0.07 0.22 0.01 -0.02 -0.00 0.00 0.04 0.01 -0.01 -0.04 0.04 0.02 -0.00 -0.01 -0.00 0.15 -0.09 -0.03 0.01 -0.26 0.04 -0.01 0.21 -0.03 -0.28 0.18 0.05 0.05 0.03 -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 0.01 0.00 0.01 -0.02 0.00 0.01 -0.01 -0.01 -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 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 -0.02 0.03 0.00 0.01 -0.04 -0.00 0.06 -0.03 -0.01 -0.01 0.01 0.00 -0.04 -0.01 0.01 -0.01 0.05 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 0.01 -0.00 -0.00 0.01 0.00 -0.01 0.00 -0.00 -0.02 0.01 0.01 0.02 -0.05 -0.01 0.01 -0.00 -0.00 0.02 0.00 0.01 0.15 -0.44 -0.02 0.53 -0.13 -0.08 -0.34 0.06 0.05 -0.18 0.54 0.03 -0.06 -0.05 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 0.00 0.00 -0.00 0.00 0.01 -0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 0.02 -0.10 -0.00 0.00 0.01 -0.01 -0.01 0.00 0.00 0.01 -0.03 0.02 0.01 0.01 0.00 0.00 0.01 -0.00 -0.00 0.01 -0.01 0.00 -0.01 0.01 -0.07 -0.00 0.00 -0.06 0.00 -0.01 0.04 -0.01 -0.01 0.04 -0.00 0.01 0.11 -0.00 0.01 0.02 -0.03 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.12 0.21 0.01 0.00 0.01 -0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.04 0.04 0.01 -0.02 0.07 -0.01 0.07 -0.04 -0.02 0.01 -0.09 0.01 -0.01 0.01 0.00 -0.02 0.06 0.03 -0.00 0.02 0.05 -0.01 -0.03 0.00 -0.37 -0.02 -0.18 -0.39 0.06 0.16 -0.03 0.03 0.02 0.15 -0.03 -0.07 0.17 0.03 0.07 -0.02 0.06 0.00 -0.04 0.01 0.01 -0.03 0.02 0.01 -0.01 -0.01 -0.01 0.01 0.01 -0.00 -0.00 0.03 -0.01 -0.02 0.03 0.00 0.09 -0.47 0.05 0.34 -0.30 -0.05 0.00 0.01 -0.00 -0.02 -0.08 0.06 0.01 0.01 0.00 -0.01 -0.02 -0.01 0.01 -0.02 -0.00 0.01 -0.02 0.07 0.04 -0.01 -0.01 0.20 0.26 -0.13 -0.17 -0.06 -0.01 -0.06 -0.10 0.00 -0.07 -0.10 0.07 0.01 0.09 -0.08 -0.02 0.01 0.00 -0.05 0.02 0.02 0.03 0.01 0.04 0.05 -0.01 -0.03 -0.00 -0.01 -0.01 -0.06 0.09 0.01 -0.01 0.01 0.00 -0.03 0.01 0.01 -0.02 0.04 -0.00 0.00 -0.03 -0.00 0.03 -0.01 -0.01 -0.00 0.01 0.00 -0.01 0.01 0.00 -0.00 0.01 -0.00 0.01 -0.01 -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 0.37 -0.38 -0.06 -0.09 0.30 -0.17 0.25 0.20 -0.13 0.13 -0.02 0.10 0.02 -0.05 -0.00 0.07 -0.06 -0.04 0.17 -0.02 -0.02 0.25 0.01 0.08 0.01 -0.09 -0.01 0.00 0.00 -0.01 0.17 -0.07 -0.03 0.07 -0.10 -0.01 -0.03 -0.02 0.00 -0.01 0.01 0.00 -0.00 0.01 0.00 0.01 -0.08 0.01 0.07 -0.06 -0.01 -0.00 -0.00 0.00 -0.01 0.08 -0.05 0.01 0.00 -0.01 0.00 0.01 -0.01 0.03 -0.01 -0.00 -0.01 -0.02 -0.05 -0.05 0.07 -0.00 0.26 -0.12 0.08 -0.23 0.01 -0.00 -0.02 0.03 0.01 -0.10 0.04 -0.06 -0.02 -0.12 0.10 -0.02 -0.00 -0.01 -0.01 0.00 0.01 0.03 0.01 0.05 0.04 -0.02 -0.05 -0.06 0.01 0.00 0.10 -0.13 -0.01 0.02 -0.01 -0.01 0.04 -0.01 -0.01 -0.00 0.00 -0.00 0.00 0.05 -0.00 -0.05 0.02 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 0.12 0.18 0.17 -0.11 0.25 0.20 0.19 -0.17 -0.06 0.32 0.04 0.19 0.33 -0.06 -0.18 -0.10 0.17 0.03 0.20 -0.02 -0.03 0.13 -0.01 0.00 -0.02 0.13 0.01 -0.06 0.01 0.02 -0.23 0.11 0.04 -0.09 0.11 0.01 0.02 0.02 -0.00 -0.01 0.01 0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 0.02 -0.03 -0.00 -0.01 -0.00 0.01 0.01 0.02 -0.02 0.00 -0.00 0.00 -0.03 -0.05 0.09 -0.11 0.01 0.08 -0.19 0.06 -0.09 0.02 -0.01 0.03 0.14 0.01 -0.03 0.07 -0.04 -0.00 0.00 0.01 -0.02 -0.00 0.00 -0.02 -0.00 0.00 0.03 0.00 0.02 0.03 -0.01 -0.02 0.03 -0.00 -0.00 -0.16 0.25 0.01 -0.04 0.02 0.01 -0.09 0.02 0.02 0.01 -0.00 -0.00 -0.01 -0.09 0.00 0.09 -0.03 -0.02 0.00 0.02 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.06 0.20 0.09 -0.03 0.04 0.15 -0.01 -0.11 0.03 0.03 0.03 0.03 0.00 0.03 -0.02 0.23 -0.43 -0.05 0.11 -0.02 -0.02 0.09 -0.00 0.02 0.05 -0.29 -0.01 0.07 -0.01 -0.02 0.45 -0.20 -0.08 0.17 -0.22 -0.02 -0.05 -0.05 0.01 -0.00 -0.00 0.00 0.00 0.01 0.01 -0.00 0.01 -0.00 0.01 -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 -0.01 -0.24 0.11 -0.01 -0.00 -0.01 0.00 -0.01 0.03 -0.00 0.05 0.01 -0.00 -0.05 -0.01 -0.01 -0.01 -0.02 0.00 -0.01 -0.00 -0.01 -0.00 -0.02 0.02 -0.09 0.02 0.04 -0.10 -0.01 -0.05 0.09 0.00 0.00 0.10 0.00 0.01 0.33 -0.03 0.01 0.03 -0.04 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 0.11 -0.15 -0.01 0.00 0.01 -0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.02 -0.00 0.01 -0.07 0.00 -0.04 -0.01 0.01 -0.01 0.06 -0.01 0.02 0.02 -0.01 0.04 0.02 0.04 -0.02 0.06 0.04 0.03 0.01 -0.02 -0.47 -0.02 -0.16 -0.51 0.05 0.16 -0.03 0.07 0.00 0.05 -0.02 0.06 0.03 -0.04 -0.04 -0.01 0.05 0.00 -0.04 0.01 0.01 -0.07 0.03 0.01 -0.01 0.01 0.01 0.01 0.02 -0.00 0.03 -0.04 0.01 0.02 0.13 -0.01 -0.05 0.27 -0.03 -0.16 0.16 0.02 -0.04 -0.01 0.01 -0.01 -0.01 0.01 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.01 0.02 -0.01 0.01 0.01 0.00 -0.00 -0.01 0.00 0.02 -0.01 -0.05 -0.02 0.06 0.18 -0.00 -0.01 0.00 0.00 0.01 0.02 0.00 0.02 -0.02 -0.12 -0.03 -0.10 0.10 -0.03 -0.10 0.09 -0.04 -0.09 -0.08 -0.03 -0.10 0.01 0.08 0.24 0.01 0.01 -0.00 0.00 -0.01 -0.00 -0.01 0.00 0.00 -0.17 -0.13 0.07 -0.01 0.00 0.00 0.00 -0.01 -0.00 0.00 0.01 -0.00 0.08 -0.02 -0.02 0.03 0.07 -0.02 0.01 0.12 -0.02 0.12 -0.04 -0.03 -0.07 -0.04 0.03 -0.02 -0.02 -0.02 0.00 -0.00 -0.06 0.01 0.04 0.00 0.23 0.03 0.09 -0.23 -0.00 0.08 -0.00 -0.01 0.01 0.14 -0.05 -0.12 -0.11 -0.05 -0.12 -0.00 0.01 0.00 -0.01 0.00 0.00 0.02 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.27 -0.13 -0.07 0.03 0.30 -0.06 0.03 -0.38 0.05 -0.33 0.24 0.07 0.03 0.02 -0.02 -0.01 -0.01 0.01 0.00 -0.00 0.01 0.00 0.00 0.00 -0.01 -0.01 0.01 0.00 0.01 -0.00 0.00 -0.01 0.00 0.02 -0.02 -0.05 -0.01 0.07 0.22 0.00 -0.00 -0.00 0.01 -0.00 0.01 -0.00 0.01 -0.01 -0.07 -0.02 -0.06 0.06 -0.02 -0.05 0.12 -0.03 -0.06 -0.11 -0.02 -0.08 -0.00 0.03 0.05 -0.01 -0.01 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 0.11 0.07 -0.04 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.04 0.01 0.01 -0.01 -0.05 0.01 -0.01 -0.08 0.02 -0.08 0.03 0.02 0.04 0.03 -0.02 -0.03 0.01 0.01 0.00 0.03 -0.02 -0.02 0.06 -0.00 -0.32 -0.03 -0.21 0.36 -0.09 -0.20 0.00 0.00 -0.00 -0.30 0.08 0.15 0.37 0.03 0.21 -0.01 0.02 0.00 0.03 -0.01 -0.01 -0.02 0.00 0.00 0.01 -0.03 -0.00 -0.00 -0.00 0.00 -0.18 0.09 0.04 -0.01 -0.19 0.03 -0.02 0.27 -0.03 0.20 -0.14 -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 0.01 0.00 0.03 0.00 0.01 -0.08 0.03 -0.00 -0.00 0.00 -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 0.01 0.00 0.01 -0.02 0.00 0.01 0.01 0.00 0.00 -0.01 0.00 0.00 0.00 -0.02 -0.05 0.25 0.15 -0.05 0.03 -0.16 -0.01 -0.11 -0.00 0.02 -0.02 -0.02 0.01 -0.18 0.05 0.03 0.01 -0.18 -0.00 0.09 0.11 -0.02 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 -0.00 0.02 -0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.01 0.01 0.00 0.01 0.01 -0.01 0.01 -0.00 -0.19 -0.02 -0.10 0.19 -0.04 -0.09 -0.06 -0.15 0.16 -0.15 0.04 0.09 0.15 0.02 0.10 0.03 -0.15 -0.00 -0.34 0.04 0.06 0.33 -0.06 -0.06 -0.22 0.46 0.04 -0.08 -0.09 0.02 0.07 -0.03 -0.02 -0.00 0.07 -0.02 0.00 -0.08 0.01 -0.06 0.05 0.02 -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 -0.02 -0.01 0.01 0.00 0.01 -0.02 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.01 -0.03 -0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 -0.04 -0.01 -0.04 0.05 -0.01 -0.03 -0.02 -0.01 -0.01 0.01 -0.01 -0.01 -0.01 0.06 0.13 0.05 0.03 -0.01 0.01 -0.03 -0.00 -0.02 0.00 0.00 0.09 0.06 -0.03 -0.03 0.01 0.01 0.00 -0.03 -0.00 0.02 0.02 -0.00 -0.04 0.01 0.01 -0.01 -0.04 0.01 -0.01 -0.07 0.01 -0.07 0.03 0.02 0.04 0.02 -0.02 0.00 -0.02 -0.02 0.00 -0.03 -0.03 0.02 -0.02 0.00 0.44 0.05 0.23 -0.42 0.07 0.21 -0.01 -0.02 0.03 0.32 -0.08 -0.20 -0.32 -0.05 -0.21 0.00 -0.02 -0.00 -0.05 0.00 0.01 0.06 -0.01 -0.01 -0.04 0.08 0.01 -0.02 -0.02 0.00 -0.13 0.07 0.03 -0.01 -0.15 0.03 -0.02 0.22 -0.03 0.17 -0.12 -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 0.03 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 0.00 0.00 0.00 -0.00 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 -0.01 -0.00 -0.00 -0.02 -0.00 0.00 -0.01 -0.00 0.00 -0.00 0.01 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.01 0.00 -0.01 -0.01 0.00 -0.12 0.10 0.02 0.02 -0.14 0.02 0.02 -0.05 0.00 -0.04 0.04 0.01 0.12 0.06 -0.05 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 0.03 -0.00 -0.01 0.00 -0.00 -0.00 0.01 -0.01 -0.01 0.02 0.00 0.01 0.01 -0.02 -0.00 -0.03 0.01 0.00 0.01 -0.00 -0.00 0.00 -0.01 -0.01 0.02 0.03 -0.00 0.45 -0.24 -0.10 0.01 0.55 -0.09 0.03 -0.32 0.04 -0.21 0.14 0.04 -0.33 -0.20 0.14 0.00 0.00 -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 -0.02 0.00 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 -0.01 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 -0.04 -0.01 0.01 0.05 -0.10 -0.01 -0.11 0.04 0.02 -0.00 -0.00 0.00 -0.02 0.01 0.00 0.02 -0.02 -0.00 0.08 0.09 -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 0.01 0.00 -0.00 -0.00 0.01 0.01 -0.00 0.01 0.00 -0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.10 -0.03 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.15 0.50 0.02 0.58 -0.11 -0.09 -0.28 0.07 0.05 0.11 -0.28 -0.02 -0.24 -0.27 0.04 0.03 -0.01 -0.01 0.00 0.03 -0.00 0.00 -0.02 0.00 -0.01 0.01 0.00 -0.02 -0.01 0.01 0.00 0.01 0.00 0.00 0.01 -0.01 -0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.02 0.13 -0.03 0.00 -0.08 0.01 -0.00 0.01 0.00 -0.01 0.00 0.01 -0.02 -0.07 0.01 0.05 -0.12 -0.03 -0.01 -0.05 0.04 0.02 -0.00 -0.00 -0.01 -0.00 -0.01 -0.02 0.00 -0.00 0.02 -0.00 0.00 -0.00 0.00 0.01 -0.01 0.01 0.01 0.00 0.02 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.01 -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 0.00 -0.24 0.39 0.35 -0.02 0.46 0.12 -0.27 0.51 -0.14 0.01 -0.02 -0.01 0.01 -0.01 -0.02 -0.06 0.07 0.03 0.03 -0.01 -0.03 -0.06 -0.01 -0.05 0.02 -0.04 -0.00 -0.03 0.01 0.01 0.09 -0.02 -0.01 -0.00 0.04 0.00 0.05 0.05 -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 0.00 -0.00 0.00 0.02 0.00 0.01 0.02 -0.01 -0.00 0.01 -0.02 -0.00 0.00 0.00 0.05 0.27 -0.06 0.01 -0.15 0.02 0.01 0.00 0.00 0.00 -0.00 -0.01 -0.05 -0.15 -0.00 -0.05 0.11 0.02 -0.01 -0.11 0.08 -0.00 0.00 0.01 0.01 -0.00 -0.00 0.01 0.00 0.00 -0.01 0.00 0.01 0.00 -0.01 -0.02 -0.02 0.01 0.02 0.01 0.03 -0.00 -0.01 0.01 -0.00 -0.00 -0.00 0.00 -0.03 0.00 0.00 0.02 -0.02 -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 0.00 0.20 -0.33 -0.30 0.01 -0.40 -0.12 0.28 -0.47 0.11 -0.04 0.00 -0.01 -0.02 0.01 0.02 -0.12 0.17 0.06 -0.04 0.01 0.03 0.00 0.01 0.02 0.04 -0.07 -0.00 -0.03 0.02 0.01 0.16 -0.04 -0.03 -0.00 0.08 0.00 0.10 0.10 -0.02 -0.01 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.01 0.01 0.00 0.00 0.00 -0.00 0.01 0.01 -0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.01 0.02 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.02 0.04 -0.00 -0.05 -0.15 -0.00 -0.00 0.01 0.00 -0.03 -0.01 0.00 -0.01 0.01 -0.16 0.02 0.04 0.18 0.00 0.03 0.18 -0.00 0.02 -0.17 0.02 0.02 -0.01 -0.04 -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 -0.01 0.00 0.00 -0.00 0.01 -0.00 0.01 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.09 0.10 -0.01 0.06 0.06 -0.04 0.11 -0.04 0.31 0.09 0.32 -0.35 0.12 0.33 -0.00 0.01 0.00 -0.29 0.12 0.29 0.24 0.08 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 -0.01 -0.00 0.00 -0.01 0.00 -0.00 -0.00 -0.03 0.01 -0.03 0.02 0.01 -0.03 -0.02 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 0.00 -0.04 -0.07 -0.01 0.05 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 0.04 -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 -0.08 -0.08 0.02 0.09 -0.01 -0.02 -0.05 0.09 0.01 0.00 0.00 -0.00 -0.11 0.08 0.02 0.10 -0.09 -0.02 -0.06 -0.07 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 0.01 0.00 -0.01 0.01 -0.00 0.01 0.00 0.00 0.01 0.00 -0.00 -0.10 0.52 -0.13 0.01 -0.00 -0.00 0.01 0.00 0.00 0.07 0.11 -0.01 0.23 0.04 -0.04 0.39 -0.02 -0.06 -0.03 0.34 0.01 0.34 0.39 -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 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 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 0.01 0.00 0.00 0.00 0.00 0.01 0.00 -0.05 -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 -0.00 -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 0.01 -0.00 0.01 -0.01 -0.00 0.01 -0.01 -0.00 -0.01 0.02 0.00 -0.01 -0.01 0.01 0.23 0.27 0.39 0.02 -0.40 -0.29 0.52 0.33 -0.28 -0.03 0.01 -0.02 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.01 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 0.03 -0.00 -0.01 0.01 0.02 -0.01 0.01 0.04 -0.01 0.05 -0.02 -0.01 0.06 0.03 -0.02 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.02 0.02 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.01 -0.00 -0.00 -0.01 -0.01 -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 0.01 0.01 -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 -0.00 -0.00 0.00 0.00 -0.12 -0.07 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.02 0.11 -0.01 0.09 -0.06 -0.02 0.09 -0.11 -0.01 -0.07 0.13 -0.00 -0.11 -0.07 0.05 -0.03 -0.07 -0.08 -0.00 0.08 0.10 -0.14 -0.07 0.06 0.01 -0.00 0.01 0.00 0.00 0.01 -0.00 0.00 -0.00 -0.02 0.00 0.02 0.02 -0.00 0.02 0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.25 -0.03 -0.08 0.10 0.19 -0.06 0.09 0.32 -0.08 0.39 -0.13 -0.10 0.53 0.30 -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 -0.01 0.00 -0.03 -0.01 0.00 0.00 -0.00 -0.00 -0.00 -0.02 0.01 -0.04 -0.00 0.00 -0.00 0.01 0.00 0.01 0.00 -0.00 -0.01 0.00 -0.00 -0.01 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 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.59 -0.08 0.12 0.01 -0.32 0.61 -0.34 0.20 0.00 -0.02 -0.01 -0.01 -0.02 0.00 0.01 0.00 -0.00 0.00 -0.02 0.00 -0.00 -0.03 -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 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 0.01 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 0.02 -0.02 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 0.01 0.02 0.00 -0.01 -0.02 0.03 -0.01 -0.02 0.03 0.00 0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 -0.08 0.12 0.01 0.01 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.00 0.00 0.12 -0.01 -0.04 -0.03 -0.12 0.03 -0.03 -0.13 0.03 0.13 -0.03 -0.04 -0.05 0.08 0.00 -0.03 -0.00 -0.01 -0.00 0.02 -0.03 0.01 -0.02 0.00 -0.09 -0.01 -0.04 -0.08 0.01 0.03 0.01 -0.03 0.00 -0.09 0.02 0.04 -0.09 -0.00 -0.05 -0.01 0.02 0.00 -0.01 0.01 0.00 -0.03 0.01 0.00 -0.00 0.01 -0.00 -0.00 0.01 0.00 -0.31 0.26 0.05 -0.06 0.48 -0.06 -0.05 0.47 -0.06 -0.35 0.28 0.06 -0.03 0.12 -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 0.01 -0.00 0.02 -0.01 -0.00 -0.00 0.00 0.00 0.01 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.01 -0.00 -0.01 -0.00 0.00 0.01 -0.01 0.00 0.01 -0.01 -0.00 -0.01 0.01 -0.00 -0.00 -0.11 0.08 0.01 -0.00 -0.13 0.00 0.09 0.04 -0.02 0.00 -0.00 -0.00 0.15 0.02 -0.02 0.03 -0.14 -0.01 -0.10 0.04 0.02 -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 0.00 -0.00 0.00 -0.00 0.03 0.00 0.01 0.03 -0.00 -0.01 0.08 -0.16 -0.02 0.03 -0.01 -0.01 0.03 0.00 0.01 -0.21 0.45 0.03 -0.38 0.15 0.06 -0.40 0.15 0.07 -0.17 0.45 0.03 -0.02 0.16 0.00 0.01 -0.01 -0.00 0.00 -0.02 -0.00 0.00 -0.01 0.00 0.02 -0.01 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 0.00 0.00 0.00 -0.03 -0.00 -0.00 -0.01 -0.00 -0.01 0.01 -0.02 0.00 -0.03 0.00 0.00 0.13 -0.00 -0.01 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.09 -0.03 -0.08 -0.08 0.03 0.09 -0.09 0.04 0.09 -0.09 -0.02 -0.09 0.15 -0.02 0.00 0.01 0.01 0.00 -0.01 0.02 0.00 0.01 -0.01 -0.00 -0.02 0.03 0.00 -0.00 -0.02 0.00 -0.01 0.00 0.00 0.02 0.02 -0.00 0.02 0.01 -0.01 -0.01 -0.01 0.01 0.00 -0.04 0.01 0.04 -0.02 -0.01 -0.02 0.02 0.00 0.07 0.01 0.04 0.00 -0.06 0.05 -0.02 0.05 -0.02 0.43 0.04 0.20 0.41 -0.06 -0.16 -0.07 0.23 -0.03 0.36 -0.08 -0.13 0.38 0.03 0.17 0.02 -0.06 -0.00 -0.04 -0.00 0.01 -0.01 -0.02 0.00 -0.00 -0.04 0.00 -0.05 -0.06 0.01 -0.05 0.05 0.01 -0.02 0.08 -0.00 -0.00 0.11 -0.02 -0.09 0.07 0.02 -0.00 0.04 -0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.02 0.00 0.00 0.01 0.01 -0.00 0.00 -0.04 -0.05 -0.03 0.04 -0.07 0.01 0.01 -0.00 -0.00 -0.02 0.00 0.00 0.01 0.02 -0.01 0.00 -0.00 0.00 0.00 0.01 -0.01 0.01 0.00 0.01 0.01 -0.01 -0.01 0.02 -0.01 -0.02 0.02 0.00 0.02 -0.03 0.00 0.00 0.00 0.06 0.01 -0.04 0.03 0.00 0.05 -0.02 -0.01 0.00 -0.00 0.00 0.02 -0.05 -0.00 -0.04 -0.04 0.01 0.05 0.08 -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 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 -0.01 0.00 -0.00 0.00 -0.07 -0.01 -0.03 -0.07 0.01 0.03 -0.26 0.84 -0.12 -0.06 0.01 0.02 -0.06 -0.00 -0.03 0.02 -0.13 0.00 -0.22 0.03 0.04 -0.12 -0.03 0.02 -0.06 -0.00 0.01 -0.18 -0.17 0.03 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.01 -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 -0.00 -0.02 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.01 0.04 -0.00 -0.11 -0.31 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.12 0.06 0.20 -0.09 0.07 0.19 0.08 -0.08 -0.21 -0.10 -0.07 -0.22 0.00 0.12 0.35 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.07 -0.06 0.03 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.06 0.02 -0.02 0.03 0.08 -0.02 -0.04 -0.07 0.02 -0.06 -0.02 0.02 0.10 0.06 -0.04 -0.03 0.00 -0.01 -0.01 0.03 -0.03 0.04 -0.04 -0.00 -0.37 0.00 -0.06 0.33 -0.01 -0.02 -0.00 -0.00 0.00 -0.27 0.01 -0.05 0.30 -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 -0.03 0.07 -0.01 0.04 -0.12 0.01 -0.05 0.09 0.00 0.02 -0.08 0.01 -0.14 -0.07 0.05 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.02 -0.02 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.01 0.04 -0.03 -0.08 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 0.01 0.04 -0.08 0.02 0.06 0.06 -0.03 -0.06 0.02 -0.02 -0.05 -0.01 0.04 0.10 0.02 0.01 -0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 0.16 0.21 -0.08 0.02 -0.00 -0.00 0.01 0.00 -0.00 -0.02 -0.01 0.00 -0.03 -0.15 0.03 -0.04 -0.30 0.06 0.04 0.31 -0.06 0.03 0.15 -0.03 -0.17 -0.20 0.08 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 -0.01 -0.00 -0.04 0.02 0.03 0.14 -0.02 -0.05 -0.01 0.03 0.00 -0.09 0.02 0.01 0.04 -0.01 -0.04 -0.01 -0.01 0.00 0.03 -0.01 -0.00 -0.03 0.01 0.00 0.01 0.00 -0.01 0.01 0.02 -0.00 -0.12 -0.12 0.06 -0.06 0.41 -0.04 0.07 -0.40 0.04 0.12 0.10 -0.05 0.31 0.06 -0.11 -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 -0.01 0.00 -0.01 0.00 -0.00 0.11 0.01 0.03 -0.00 -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.17 -0.02 -0.07 -0.14 0.01 0.02 0.13 -0.01 0.00 0.14 0.01 0.06 -0.06 -0.02 -0.05 0.06 0.05 -0.01 -0.03 -0.02 0.00 -0.06 -0.01 0.01 -0.21 -0.00 0.06 0.06 0.01 -0.01 0.02 0.03 -0.00 -0.05 -0.05 0.01 0.25 -0.12 -0.06 0.12 -0.08 -0.03 -0.12 0.09 0.02 -0.25 0.12 0.06 0.21 0.01 -0.07 0.02 -0.00 0.00 0.00 -0.02 0.01 -0.00 0.01 -0.00 0.23 0.05 0.16 0.14 -0.05 -0.13 -0.05 0.11 0.00 -0.07 0.04 0.12 -0.13 -0.03 -0.11 -0.04 -0.00 0.01 0.07 -0.04 -0.01 -0.06 0.04 0.01 0.04 -0.02 -0.01 0.04 0.06 -0.01 -0.27 0.19 0.05 0.13 0.08 -0.05 -0.13 -0.10 0.05 0.27 -0.22 -0.05 -0.15 -0.21 0.08 -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 -0.02 -0.01 -0.02 -0.05 0.01 0.00 -0.00 0.00 -0.02 -0.00 -0.00 0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 0.01 -0.00 0.03 0.00 0.01 0.03 -0.00 -0.01 -0.03 0.00 0.00 -0.03 -0.00 -0.01 0.01 0.00 0.00 0.23 0.21 -0.03 -0.08 -0.13 0.01 -0.20 -0.07 0.03 0.04 -0.01 -0.01 0.19 0.06 -0.03 0.07 0.16 -0.01 -0.20 -0.21 0.03 -0.05 0.03 0.01 -0.02 0.03 0.00 0.02 -0.03 -0.00 0.05 -0.03 -0.01 -0.03 0.01 0.01 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.04 -0.01 -0.03 -0.03 0.01 0.03 -0.21 0.48 0.01 0.02 -0.01 -0.02 0.02 0.00 0.02 -0.16 0.06 0.02 0.26 -0.19 -0.04 -0.19 0.15 0.03 0.19 -0.12 -0.03 0.21 0.26 -0.04 0.06 -0.03 -0.01 -0.02 -0.04 0.01 0.02 0.04 -0.01 -0.07 0.04 0.01 0.01 0.04 -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 0.01 0.01 -0.02 0.02 -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 0.01 0.00 0.02 0.00 0.00 0.02 -0.00 -0.01 -0.02 0.00 0.01 -0.02 0.00 -0.00 0.01 -0.00 -0.00 0.12 -0.17 -0.02 -0.15 0.28 0.03 -0.23 0.14 0.04 -0.00 -0.01 0.00 0.22 -0.14 -0.04 0.14 -0.26 -0.02 -0.07 0.13 0.01 -0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 0.00 -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 0.02 -0.13 0.06 0.02 -0.01 -0.01 0.02 0.00 0.02 0.07 -0.42 -0.01 0.37 0.02 -0.06 -0.31 -0.03 0.05 -0.07 0.36 0.01 -0.15 0.05 0.03 0.01 -0.00 -0.00 -0.00 -0.02 -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 0.01 -0.00 -0.00 -0.00 0.01 0.00 0.00 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.02 0.00 0.00 0.16 -0.01 -0.02 -0.00 -0.01 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.23 -0.01 -0.05 -0.24 0.03 0.07 0.25 -0.04 -0.07 0.24 0.00 0.06 -0.18 0.03 0.02 0.00 -0.01 -0.00 -0.01 0.01 0.00 -0.01 0.01 0.00 0.12 -0.07 -0.03 0.01 -0.01 -0.00 0.01 -0.01 -0.00 -0.00 0.01 0.00 -0.16 0.10 0.03 -0.06 0.11 0.00 0.06 -0.10 -0.00 0.13 -0.09 -0.03 -0.09 0.03 0.02 0.02 -0.00 0.00 -0.00 -0.02 0.00 0.01 0.00 -0.00 0.23 0.07 0.21 0.26 -0.07 -0.20 0.00 -0.02 0.00 -0.25 0.09 0.19 -0.21 -0.06 -0.21 0.00 -0.02 -0.00 0.01 0.00 -0.00 -0.01 -0.00 0.00 -0.00 0.02 0.00 -0.01 0.00 0.00 0.21 -0.11 -0.04 -0.06 -0.15 0.04 0.07 0.11 -0.04 -0.17 0.10 0.04 0.03 0.10 -0.03 -0.01 -0.02 -0.03 -0.03 0.00 -0.44 -0.08 -0.15 -0.20 0.00 -0.00 -0.00 -0.02 -0.03 -0.08 0.01 -0.00 0.01 -0.02 -0.01 -0.05 0.02 0.00 0.01 0.05 -0.01 0.71 -0.00 0.01 0.01 0.13 0.27 0.30 -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 0.01 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 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.04 -0.06 -0.04 -0.01 -0.03 0.02 -0.02 -0.02 0.03 -0.03 -0.03 -0.00 0.01 0.00 -0.01 -0.05 0.14 0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.01 0.00 -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 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.02 -0.02 0.02 -0.00 0.26 -0.13 -0.24 -0.33 0.00 -0.00 -0.00 -0.01 -0.00 -0.02 0.00 0.00 -0.00 -0.01 -0.04 0.00 -0.01 0.00 0.00 -0.03 -0.00 -0.43 0.00 0.00 -0.00 0.22 0.40 0.56 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 -0.02 -0.00 0.00 0.01 -0.01 -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 -0.02 0.04 0.03 0.01 -0.00 -0.01 -0.00 0.03 -0.02 0.01 0.01 -0.01 -0.03 0.01 0.01 0.03 -0.13 0.07 0.01 -0.00 -0.00 0.00 0.00 0.01 0.00 0.02 0.00 -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 0.01 -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 -0.03 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 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.16 -0.38 0.39 0.65 0.08 0.01 -0.14 -0.15 -0.45 -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 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.08 -0.05 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 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.15 0.40 -0.41 0.73 0.08 0.02 0.07 0.09 0.28 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 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 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 -0.09 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 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.16 -0.39 0.37 0.12 0.02 -0.01 0.23 0.26 0.74 0.03 -0.01 -0.05 -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 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.07 -0.02 0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 0.04 -0.00 -0.01 -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 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.80 0.28 -0.14 -0.01 -0.03 0.00 -0.10 -0.45 0.02 0.09 0.03 -0.02 -0.13 0.12 0.02 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -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 0.04 -0.00 -0.01 -0.03 -0.05 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 -0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.02 0.01 -0.00 -0.01 0.01 0.00 0.07 0.13 -0.04 -0.16 0.00 0.05 -0.43 0.01 0.13 0.32 0.58 -0.20 0.25 -0.45 -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 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.03 0.01 -0.01 0.00 0.01 -0.00 -0.00 0.00 -0.00 0.00 0.03 -0.00 -0.05 -0.01 0.01 0.04 -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 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.35 -0.12 0.06 -0.03 -0.14 0.01 -0.07 -0.33 0.01 0.53 0.18 -0.09 -0.46 0.41 0.08 -0.01 -0.02 0.01 0.02 -0.00 -0.01 0.05 -0.00 -0.02 0.01 0.02 -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 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 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 0.01 0.00 -0.00 -0.06 0.00 0.02 -0.02 -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 0.00 -0.00 0.00 0.00 -0.00 -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 -0.00 0.00 0.01 -0.00 0.01 0.04 -0.00 -0.02 -0.01 0.00 0.03 -0.03 -0.01 -0.12 -0.23 0.08 -0.15 0.00 0.05 0.70 -0.01 -0.22 0.27 0.49 -0.17 -0.06 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 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 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 0.00 0.01 0.02 -0.00 0.00 0.00 -0.00 -0.01 -0.06 0.00 -0.05 -0.02 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 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.27 0.09 -0.05 -0.05 -0.22 0.01 0.13 0.64 -0.02 0.60 0.21 -0.11 0.07 -0.07 -0.01 0.00 0.00 -0.00 0.05 -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 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 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 0.01 0.00 0.01 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 -0.00 -0.02 -0.03 0.01 0.02 0.00 -0.01 0.02 0.00 -0.01 -0.01 -0.02 0.01 0.03 -0.06 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.01 -0.08 0.04 0.13 -0.03 -0.02 -0.05 -0.00 0.00 0.00 -0.07 -0.04 -0.12 -0.07 0.04 0.10 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 0.21 0.40 -0.13 -0.28 0.01 0.09 -0.18 -0.00 0.06 0.11 0.20 -0.07 -0.36 0.63 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 0.03 -0.01 -0.04 0.01 0.00 0.02 0.02 0.01 0.04 0.02 -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 0.01 0.01 -0.00 -0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.01 0.00 -0.00 -0.01 0.01 0.01 0.00 -0.00 0.01 0.01 0.03 -0.31 0.17 0.51 -0.10 -0.05 -0.17 0.00 0.00 -0.00 -0.27 -0.13 -0.45 -0.23 0.14 0.35 -0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.00 -0.06 -0.11 0.04 0.07 -0.00 -0.02 0.05 0.00 -0.02 -0.03 -0.06 0.02 0.10 -0.17 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -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 0.01 0.02 -0.01 -0.01 -0.02 0.03 -0.02 -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 0.01 -0.00 -0.00 -0.00 0.00 -0.01 -0.01 -0.02 0.18 -0.10 -0.31 -0.16 -0.09 -0.28 -0.00 0.00 0.00 0.17 0.09 0.29 -0.40 0.24 0.63 -0.00 -0.00 0.00 0.00 0.00 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 0.00 -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 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -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 0.01 0.03 -0.00 0.00 0.00 -0.00 0.01 0.04 -0.00 -0.02 -0.01 0.00 -0.05 0.04 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 -0.00 0.00 -0.00 -0.00 -0.00 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 -0.14 -0.05 0.02 -0.08 -0.36 0.01 -0.10 -0.46 0.02 0.28 0.10 -0.05 0.53 -0.47 -0.09 0.01 0.02 -0.01 0.06 -0.00 -0.02 -0.00 -0.00 0.00 0.01 0.02 -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 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.03 -0.06 0.02 -0.04 0.00 0.01 -0.03 0.00 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 -0.00 -0.00 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 -0.00 0.00 0.01 -0.00 -0.04 -0.01 0.01 -0.02 0.02 0.00 0.33 0.63 -0.20 0.50 -0.01 -0.16 0.35 -0.01 -0.11 0.03 0.06 -0.02 0.09 -0.17 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 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 -0.06 0.00 0.02 0.02 -0.00 -0.01 -0.01 -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 -0.01 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 0.04 -0.00 0.00 0.01 -0.00 -0.04 -0.01 0.01 -0.02 0.02 0.00 -0.15 -0.29 0.09 0.71 -0.02 -0.23 -0.27 0.01 0.08 0.15 0.28 -0.10 -0.17 0.30 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 0.00 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 -0.08 0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -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 0.00 -0.00 -0.00 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 0.02 0.01 0.04 -0.00 0.00 0.00 -0.04 -0.02 -0.06 -0.01 0.01 0.01 -0.02 -0.01 0.00 0.18 0.86 -0.03 -0.02 -0.10 0.00 0.36 0.12 -0.06 0.16 -0.14 -0.03 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 -0.01 -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 0.03 -0.02 -0.05 -0.01 -0.00 -0.01 -0.03 -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 -0.01 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 0.01 0.00 0.00 -0.00 0.01 0.01 0.03 -0.33 0.18 0.54 0.06 0.03 0.09 -0.00 0.00 0.00 0.37 0.18 0.61 -0.02 0.01 0.03 -0.00 -0.00 0.00 0.02 0.07 -0.00 -0.00 -0.01 0.00 0.03 0.01 -0.01 0.01 -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 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 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 -0.02 -0.07 0.00 0.00 0.01 0.02 -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 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 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 0.44 0.24 0.75 -0.00 -0.00 -0.00 -0.05 -0.02 -0.08 -0.21 0.12 0.32 -0.00 -0.00 0.00 -0.01 -0.05 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 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.07 -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 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.90 0.34 0.27 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 8 8 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 8 8 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.99491 15.99491 15.99491 15.99491 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 374.12666 0.99988 -0.01474 -0.00401 0.01475 0.99989 0.00271 0.00397 -0.00276 0.99999 asymmetric 1 0.01193 0.00655 0.00473 0.24860 0.13656 0.09860 938818.0 7.06 31.57 42.50 55.06 67.45 74.37 89.02 112.80 141.70 170.73 236.32 270.99 285.92 308.96 321.77 354.64 377.28 394.47 439.41 466.33 478.00 519.49 569.38 598.67 600.01 608.96 624.77 639.87 692.62 721.72 748.04 777.99 806.43 864.02 876.75 895.31 910.64 915.86 936.72 942.83 1009.30 1010.79 1027.69 1043.51 1056.37 1094.08 1098.09 1102.51 1105.92 1153.54 1198.12 1205.65 1212.16 1223.04 1227.16 1260.68 1279.08 1295.81 1310.40 1370.38 1400.73 1407.02 1409.81 1426.73 1433.02 1437.03 1444.46 1454.34 1458.84 1487.93 1503.27 1513.62 1581.86 1584.76 1588.85 1612.35 1645.97 1659.39 1706.27 1713.98 1715.48 1723.03 1726.09 1751.44 1763.69 1774.25 1796.47 1800.16 1815.17 1897.83 1915.58 1919.52 1921.27 1945.56 1960.72 2032.04 2044.98 2072.69 2123.01 2137.07 2137.53 2148.85 2183.77 2199.43 2212.45 2218.37 2327.20 2341.66 2350.85 2354.76 2365.85 2374.59 2628.93 2715.13 4385.93 4494.37 4512.98 4542.28 4551.82 4560.87 4563.84 4573.89 4585.95 4586.43 4588.70 4591.84 4597.70 4601.22 4606.59 4607.74 4615.54 5133.63 0.357577 0.380687 0.381631 0.301065 -1259.603392 -1259.580282 -1259.579338 -1259.659904 238.885 90.920 169.566 0.000 0.000 0.000 0.889 2.981 43.651 0.889 2.981 35.817 237.107 84.958 90.098 1 0.593 1.987 9.424 2 0.593 1.985 6.450 3 0.593 1.984 5.860 4 0.594 1.982 5.347 5 0.595 1.979 4.945 6 0.596 1.977 4.752 7 0.597 1.973 4.396 8 0.600 1.964 3.931 9 0.604 1.950 3.484 10 0.609 1.934 3.122 11 0.623 1.886 2.500 12 0.633 1.856 2.244 13 0.637 1.842 2.145 14 0.645 1.819 2.003 15 0.649 1.805 1.929 16 0.661 1.769 1.756 17 0.670 1.742 1.647 18 0.676 1.721 1.570 19 0.696 1.663 1.387 20 0.709 1.627 1.289 21 0.714 1.611 1.249 22 0.735 1.552 1.118 23 0.762 1.479 0.978 24 0.779 1.435 0.905 25 0.780 1.433 0.902 26 0.785 1.420 0.881 27 0.795 1.396 0.845 28 0.804 1.373 0.812 29 0.838 1.291 0.706 30 0.857 1.246 0.654 31 0.875 1.206 0.610 32 0.896 1.160 0.564 33 0.916 1.117 0.523 34 0.959 1.031 0.449 35 0.968 1.012 0.434 0.985659e+26 25.993727 59.852767 0.231006e+11 10.363624 23.863125 0.100000e+01 0.000000 0.000000 0.284434e+09 8.453982 19.466013 0.150010e+08 7.176121 16.523629 gas ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] -0.4764 -0.1699 -0.3219 0.5995 -152.0542 -148.2751 -178.9767 -4.9895 -7.1772 0.1092 7.7145 11.4935 -19.2080 -4.9895 -7.1772 0.1092 19.7891 28.3913 5.1417 44.1729 23.1856 0.6175 -35.2655 -27.0211 -15.4776 -4.8032 -8221.0916 -4541.4708 -989.9502 -14.6320 -252.4053 -47.7975 25.7519 6.6642 9.1250 -2115.3355 -1884.1801 -1009.6432 -34.9767 -19.3892 16.0172 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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 -1259.9609689 6.023E-9 5.431E-6 0.3575769 0.3806869 -1259.580282 -1259.5793378 -1259.6599041 4.8895976,8.2430071,-13.1326047,-1.9290298,-4.8300635,6.1609143 C01 [X(C22H18N2O4)] -0.19047 0.0015242 -0.1391352 -0.7185649 -0.334521 -0.3023951 -0.457009 -1.0933251 -0.3253969 -0.3253865 -0.1558019 -0.6646624 -0.4356371 -0.0751569 0.0106357 -0.142282 -0.4382451 0.1617435 0.1033553 -0.1091418 -1.2014546 -0.6083982 -0.1019711 -0.3695731 -0.2121831 -0.5732804 -0.22194 -0.5459519 -0.0691024 -1.1710234 -1.5330591 0.7883322 0.1221721 0.9702823 -1.2637976 -0.2181871 0.3320042 -0.3715609 -0.2763623 -0.3690611 0.0044262 -0.2654762 -0.10955 -0.3054355 -0.1714875 -0.3011894 0.1825931 -1.0857994 -0.2524284 0.4828596 0.1942909 0.1869889 -0.4392796 -0.1272661 0.3019829 -0.4539021 -0.3795175 0.381103 -0.1478161 0.1714838 -0.1090767 0.2966912 0.1659314 0.4010903 0.2796316 0.475924 0.1143132 0.0546518 -0.0261002 -0.0266371 -0.2072672 -0.0084195 0.0553987 -0.0329617 -0.1328446 0.5285626 0.3771243 0.2811106 0.6048284 0.709593 0.2268567 -0.0366116 0.3370094 1.6543189 -0.0190495 0.0152526 -0.0007805 -0.0057176 0.029394 -0.072822 -0.0544678 -0.0062036 0.0032143 0.9145986 0.3815152 0.523082 0.6767175 1.3671323 0.2191935 0.7927254 -0.2315007 1.8775269 0.0053234 -0.0451897 -0.0453414 -0.0219563 -0.1100411 -0.0122372 -0.0086941 0.0331885 0.0355805 -0.0073506 -0.0789997 0.0183557 -0.0945333 -0.1075676 0.0099655 -0.0745419 0.0264561 0.023678 -0.1900396 0.0798798 0.0691708 0.1201482 -0.1554506 -0.016264 0.183974 -0.0277647 0.0224468 -0.2528784 0.144163 -0.015472 -0.0024844 -0.1308367 0.0322528 -0.1812114 0.0563741 -0.0114516 1.4519616 -0.7542151 -0.0859567 -0.4408653 0.2605256 0.0214044 -0.0483445 0.0448952 0.1817301 0.3017431 -0.7321727 -0.2065285 -0.4404664 0.7692331 0.2310113 -0.1677206 0.2784499 0.1578571 0.0460381 0.023901 -0.0294865 0.2000438 -0.3076083 -0.0619755 0.0189416 -0.0294475 -0.1503758 -0.1794423 0.3076649 0.0817768 -0.0016187 -0.1450516 0.003884 0.0052232 -0.0201089 -0.1033255 0.4671326 -0.4229594 -0.1190101 -0.9186941 1.3048587 0.2429639 -0.3721119 0.357771 0.1454787 0.1375393 0.0303896 -0.0221541 -0.0371429 0.1110936 0.0657293 -0.0372565 0.0606941 -0.0997353 0.1086737 -0.0293871 -0.0310871 0.0521993 0.1778017 0.0603952 -0.0406501 0.0751144 -0.0784638 -0.1409662 -0.0789222 -0.0304856 -0.0880859 -0.1375233 0.0246366 -0.0313864 0.011005 -0.1416412 -0.1723281 0.2755918 0.0202879 0.1395035 -0.141286 -0.0030945 0.0080665 -0.0392348 -0.1403153 -0.048757 -0.101912 -0.0190003 0.2566999 -0.3420411 -0.0637185 -0.0127104 -0.0163709 -0.1206744 0.0998725 -0.0140992 -0.075799 0.0310784 0.1125686 0.0161226 -0.0592062 0.0368518 -0.1069724 0.1369942 0.0128726 -0.0745062 -0.0671666 0.1120491 0.0443198 -0.1088779 0.0294944 -0.0902288 -0.2014513 -0.0323697 -0.001942 -0.0222007 -0.0259608 0.0361506 0.0082916 0.0278155 -0.1476537 0.0534361 -0.0590448 0.0493403 -0.0363554 -0.0331155 0.0205989 0.0392425 0.0601571 0.0352185 -0.1358906 0.0559511 0.0076144 0.0241679 0.0417542 -0.0139836 -0.0017837 -0.0075726 0.0838047 0.0796934 -0.004165 -0.0587755 -0.0111501 0.0573485 0.0262533 -0.0558933 -0.0198744 -0.0343278 0.0592738 0.0474409 0.0594897 0.0069289 0.1141887 -0.011796 0.0605805 -0.0290165 0.0260752 0.0916126 0.0330084 -0.0413696 0.018248 0.1201654 -0.0159195 -0.0535516 -0.0210894 0.0169516 0.2283954 -0.0318002 -0.0352841 0.0074706 0.0126409 -0.0346887 -0.1509823 0.0267866 0.2464044 0.0378266 0.0033855 -0.0525221 0.0205824 0.1398466 0.0128643 -0.0643373 0.0087398 0.0076593 0.0350827 0.0119705 0.0414483 0.0317745 0.1352895 -0.035697 0.0638372 -0.0443843 0.0125804 -0.09802 -0.012925 0.0229191 0.006408 0.0776644 -0.0152263 0.0242156 -0.0158446 0.1279013 0.0709077 -0.0466029 -0.0004675 -0.0164759 -0.0011724 -0.0252264 0.0000362 -0.0440244 0.074002 0.041551 -0.0626721 -0.0076106 -0.0682392 -0.0738479 -0.0438585 -0.0077697 -0.0477052 0.1204298 -0.0486295 -0.0062914 0.0211215 -0.0161515 0.0515928 -0.0043572 0.0454144 -0.0010072 0.1001678 0.0124632 0.0832794 0.0376868 0.0659875 -0.0211667 -0.050249 0.0364003 -0.0496098 0.1214162 0.0516317 -0.0618772 0.0197282 -0.0753948 -0.0061788 -0.001447 0.0218999 -0.0019683 0.1348493 -0.0280041 0.0381858 0.0489893 -0.0002102 0.0981114 -0.0121723 0.0919418 -0.0218719 0.0953101 -0.0915498 0.0261429 0.0607844 0.0292848 0.0662069 -0.0134044 0.0700135 -0.0207837 0.1136561 0.0264319 -0.0849394 0.0272596 -0.0876809 -0.0314838 -0.001069 0.0385072 0.0009201 0.1137728 0.0493441 0.0420203 0.0283761 0.0599851 -0.0747873 -0.0403736 0.0374943 -0.0460937 0.1288753 329.0687848|-20.943904|291.1792838|-7.7634193|30.8437931|208.5579865 0.000011600 0.000006657 0.000012380 -0.000000444 -0.000001746 0.000004153 -0.000000488 0.000004724 0.000004192 -0.000006309 0.000002146 0.000004624 0.000006903 0.000008162 -0.000007291 -0.000007631 -0.000000485 0.000007391 -0.000005309 -0.000013058 -0.000013352 -0.000004779 0.000000119 -0.000016279 -0.000002160 0.000010941 -0.000006155 0.000001408 0.000004929 0.000004926 -0.000007580 -0.000012724 0.000000730 0.000016769 -0.000003725 0.000008052 -0.000012108 0.000004865 0.000011139 -0.000014011 0.000004072 0.000010468 0.000014609 -0.000005477 0.000004628 0.000001296 0.000000373 -0.000021863 0.000004512 -0.000003041 -0.000000510 0.000001050 -0.000000584 -0.000001561 -0.000000735 0.000000046 -0.000001056 0.000009426 -0.000010795 0.000004519 -0.000003116 -0.000000362 0.000001236 -0.000000014 0.000000344 -0.000000173 0.000000987 -0.000001220 -0.000000505 0.000000152 -0.000001256 -0.000002444 -0.000002543 0.000009329 -0.000000888 0.000004353 0.000003421 -0.000001410 0.000001721 -0.000003512 -0.000000326 -0.000004490 -0.000000391 0.000000107 0.000000377 -0.000000173 0.000000021 0.000000078 0.000000750 -0.000000764 -0.000001168 -0.000000446 -0.000000542 -0.000001087 0.000000400 -0.000000447 -0.000000394 -0.000000656 -0.000001046 -0.000001218 -0.000000810 -0.000004566 0.000000880 -0.000000511 -0.000000209 -0.000002975 0.000002021 -0.000000375 -0.000000201 0.000000265 0.000000337 0.000001808 -0.000000735 0.000000573 -0.000000319 -0.000000253 -0.000000682 0.000001313 0.000000454 -0.000001163 -0.000000027 0.000000100 0.000000550 -0.000000599 0.000000088 0.000001291 0.000000237 0.000001005 0.000001744 0.000000125 -0.000002454 0.000000378 -0.000000931 -0.000000343 0.000000008 0.000001033 -0.000000455 0.000000159 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; Gaussian 16 4-May-2022 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 132 C1[X(C22H18N2O4)] RB3LYP 6-311+G(d,p) SP #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/famoxadone/gas/CONF #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read ou 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=1,74=-5,116=-2,124=31/1,2,3 4/5=1/1 5/5=2,38=6/2 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,6=200,9=1/99 Wavefunction famoxadone CONF42 gas 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 16 16 16 16 14 14 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.9949146 15.9949146 15.9949146 15.9949146 14.0030740 14.0030740 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5.6000000 5.6000000 5.6000000 5.6000000 4.5500000 4.5500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 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 752 A 724 A 724 1152 752 98 98 2542.8422922998 46 46 46 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=131 Grimme-D3 -0.0530545778 0.000000 3.520807 0.000000 2.266942 4.584388 0.000000 6.351374 6.423777 7.620242 0.000000 2.232703 2.328841 2.323536 6.788034 0.000000 3.550733 2.914668 2.883475 7.467325 1.379892 0.000000 1.458437 2.463196 3.466174 5.691163 2.309200 3.644816 0.000000 2.441592 3.095681 4.266115 4.168743 3.208240 4.356476 1.527056 0.000000 2.352764 1.200193 3.467595 6.221308 1.387683 2.444482 1.538801 2.461428 0.000000 2.418611 3.086862 4.532873 6.531570 3.496124 4.804456 1.520303 2.566545 2.550847 0.000000 1.351789 3.484201 1.193744 6.879784 1.408774 2.454940 2.313340 3.229200 2.323123 3.460620 0.000000 3.745482 3.141137 5.537099 3.659415 4.086175 5.061438 2.525968 1.398937 3.037587 3.138645 4.447007 0.000000 2.749741 4.263543 4.163422 3.673560 3.761412 4.796579 2.549356 1.397805 3.473043 3.678446 3.415153 2.413368 0.000000 4.858396 4.309382 6.485750 2.388278 5.172677 6.001429 3.810880 2.422312 4.271228 4.472234 5.495232 1.391075 2.789069 0.000000 4.137510 5.185252 5.357755 2.407727 4.918570 5.778130 3.825696 2.420251 4.590693 4.866772 4.696944 2.786181 1.391526 2.417841 0.000000 5.005421 5.190400 6.397041 1.382598 5.507930 6.299588 4.309213 2.786222 4.902506 5.183393 5.585306 2.403321 2.405584 1.390994 1.391545 0.000000 4.263531 3.752785 3.383540 7.023811 2.383509 1.422641 4.386184 4.662813 3.342390 5.747423 3.170353 5.300614 4.792735 5.952209 5.502323 6.024156 0.000000 5.535292 4.957245 4.261416 8.122516 3.636676 2.422060 5.758746 6.052682 4.659507 7.084740 4.329471 6.654067 6.101783 7.224669 6.716919 7.234489 1.398524 0.000000 4.191240 3.873563 3.757028 5.727689 2.813110 2.465133 4.176321 3.986833 3.434915 5.654343 3.401044 4.538221 3.889467 4.935650 4.343477 4.827549 1.396797 2.417326 0.000000 6.984986 6.941681 7.899071 1.383680 7.127461 7.584508 6.444203 4.978673 6.753106 7.479131 7.279965 4.579997 4.349397 3.384945 3.062779 2.373497 6.893630 7.815923 5.521065 0.000000 6.506551 5.990892 5.235633 8.126351 4.785594 3.700821 6.719133 6.749749 5.724246 8.130752 5.369032 7.269708 6.598262 7.603365 6.961203 7.438085 2.415292 1.390401 2.786119 7.589705 0.000000 5.415541 5.138829 4.833879 5.748662 4.198155 3.729714 5.433462 4.993952 4.788345 6.928917 4.656065 5.414655 4.641490 5.490559 4.726150 5.143100 2.413372 2.781243 1.393696 5.210924 2.403941 0.000000 6.465744 6.078195 5.487855 7.044583 5.021562 4.221256 6.592520 6.310718 5.788411 8.073646 5.514196 6.744384 5.981873 6.847122 6.094057 6.515727 2.799689 2.419683 2.422574 6.376620 1.395458 1.392320 0.000000 8.233159 8.335469 9.084313 2.360957 8.464478 8.897244 7.763239 6.280233 8.131776 8.763915 8.541511 5.894756 5.541916 4.642975 4.183226 3.595841 8.128291 8.962426 6.737344 1.394056 8.597014 6.256746 7.302232 0.000000 6.713231 6.365166 7.330638 2.440235 6.452226 6.688215 6.210737 4.894137 6.224736 7.413706 6.759786 4.583757 4.350935 3.622834 3.320194 2.837673 5.845539 6.643351 4.474958 1.395334 6.321793 3.997316 5.089859 2.424375 0.000000 9.112674 9.115731 9.691425 3.641675 9.125599 9.376917 8.721181 7.298179 8.931690 9.835917 9.250129 6.969535 6.519384 5.773977 5.218890 4.757954 8.435505 9.081056 7.052968 2.405654 8.509144 6.311586 7.146034 1.391644 2.790859 0.000000 7.776564 7.371830 8.081646 3.693988 7.311672 7.329591 7.383755 6.155283 7.251915 8.664230 7.647052 5.911630 5.549585 4.998010 4.560932 4.218984 6.281677 6.818824 4.953255 2.405908 6.217829 4.099100 4.879106 2.787245 1.394468 2.408132 0.000000 8.916468 8.698297 9.241845 4.168033 8.619303 8.677871 8.562288 7.252642 8.551700 9.799447 8.856084 6.985314 6.529913 5.929394 5.382364 5.016063 7.611060 8.100147 6.275602 2.786299 7.404129 5.358104 6.028138 2.420642 2.422867 1.395810 1.393246 0.000000 2.696493 4.108988 4.913152 6.475124 4.295305 5.656404 2.147327 2.804259 3.486611 1.090686 3.959317 3.444240 3.651903 4.618870 4.776042 5.176180 6.506106 7.859441 6.286546 7.525965 8.842903 7.488988 8.690371 8.726569 7.640601 9.872276 8.934568 9.972591 0.000000 2.635944 3.319981 4.426942 7.571449 3.516706 4.747112 2.157140 3.500320 2.789591 1.091601 3.463180 4.141498 4.540770 5.505052 5.811805 6.208590 5.881742 7.131288 6.038790 8.463753 8.293961 7.382775 8.413971 9.765983 8.306588 10.794551 9.504972 10.684956 1.780136 0.000000 3.365696 2.908058 5.425599 6.438185 4.019955 5.210908 2.149241 2.828973 2.804544 1.090147 4.287555 2.881921 4.126777 4.193513 5.130711 5.152914 6.125856 7.461744 5.983833 7.435069 8.481352 7.225433 8.388789 8.728288 7.396418 9.827175 8.675822 9.812119 1.777629 1.773216 0.000000 4.129962 2.704187 5.960553 4.526129 4.223197 5.151360 2.718452 2.155800 2.953586 2.965234 4.797499 1.082660 3.397027 2.140882 3.868227 3.381151 5.577841 6.906996 5.015764 5.433564 7.631137 5.987005 7.241420 6.744615 5.369814 7.797676 6.654814 7.767716 3.465015 3.874569 2.368640 0.000000 2.357189 4.718560 3.458846 4.546802 3.672846 4.711578 2.758177 2.153757 3.727833 3.905227 2.949209 3.396367 1.081738 3.870792 2.142834 3.384174 4.728946 5.971342 3.969271 5.095159 6.497511 4.733154 5.973083 6.196468 5.034231 7.083908 6.099847 7.048235 3.801949 4.593793 4.587729 4.295626 0.000000 3.934252 3.643394 2.833280 8.419534 1.980007 1.012147 4.258807 5.158968 3.148149 5.273890 2.718293 5.953176 5.568318 6.952551 6.624283 7.233119 2.056461 2.580540 3.291537 8.536321 3.952218 4.446879 4.720627 9.831709 7.636558 10.286755 8.229212 9.562736 6.111760 5.020919 5.765061 6.007481 5.341373 0.000000 5.841220 4.798322 7.476882 2.600955 5.992506 6.730167 4.683828 3.410589 4.993197 5.185229 6.453785 2.161217 3.871686 1.082838 3.391389 2.139571 6.664802 7.881870 5.662395 3.547235 8.209756 6.126365 7.429882 4.687047 3.857631 5.803485 5.163803 6.011704 5.368245 6.202948 4.710325 2.483752 4.953365 7.701452 0.000000 4.757261 6.142727 5.681662 2.637092 5.602166 6.377503 4.703067 3.406644 5.471465 5.775698 5.221174 3.869198 2.157865 3.393494 1.083123 2.143298 5.946140 7.048049 4.732610 2.992876 7.138000 4.877991 6.169412 3.853445 3.350828 4.792681 4.400304 5.029218 5.601213 6.675744 6.131660 4.951105 2.481056 7.173393 4.274820 0.000000 5.946192 5.297136 4.509184 9.111730 3.963700 2.631958 6.228043 6.738111 5.043637 7.433203 4.669428 7.369903 6.896170 8.062289 7.629449 8.163318 2.155039 1.085187 3.400487 8.861578 2.150947 3.866430 3.402471 10.029441 7.701704 10.163373 7.891538 9.176319 8.258215 7.323841 7.825461 7.519127 6.710712 2.396214 8.713165 7.998506 0.000000 3.495186 3.341364 3.636990 4.895650 2.522940 2.718342 3.307946 2.929714 2.815127 4.796648 3.022706 3.501706 2.876127 3.938868 3.391584 3.870876 2.161255 3.404354 1.082129 4.897588 3.868147 2.143852 3.396329 6.189269 4.041513 6.700884 4.802976 6.112338 5.365308 5.314508 5.105478 4.065549 3.109266 3.643392 4.740326 3.925983 4.303204 0.000000 7.491055 6.940330 6.059891 9.123194 5.733990 4.561484 7.751022 7.828349 6.713750 9.139195 6.299480 8.342214 7.667346 8.663066 8.012351 8.486536 3.393472 2.140853 3.870170 8.511082 1.084085 3.389855 2.154332 9.450549 7.210938 9.249315 6.960660 8.071380 9.868199 9.245452 9.493581 8.676792 7.530064 4.648869 9.240232 8.142383 2.465834 4.952222 0.000000 5.731165 5.589744 5.426132 4.933277 4.840991 4.602057 5.670669 4.944700 5.243883 7.154100 5.184495 5.251935 4.414758 5.066057 4.187747 4.524130 3.390095 3.865190 2.140798 4.252719 3.390600 1.084041 2.151962 5.221351 3.031608 5.236494 3.074059 4.307408 7.606660 7.742089 7.409085 5.943250 4.612827 5.386116 5.663985 4.216886 4.950372 2.451412 4.292314 0.000000 7.425095 7.072679 6.442788 7.345586 6.080910 5.304573 7.552285 7.143435 6.809045 9.046014 6.516594 7.512664 6.703179 7.452759 6.632401 7.003866 3.883053 3.401480 3.404718 6.498115 2.156370 2.154543 1.083381 7.253064 5.189573 6.892673 4.687438 5.674985 9.620967 9.434262 9.343556 8.057649 6.708783 5.785494 7.976101 6.579782 4.297165 4.289365 2.487400 2.486555 0.000000 8.627640 8.897361 9.646425 2.550166 9.085344 9.638310 8.143014 6.627207 8.671541 9.012157 9.078157 6.209258 5.882981 4.916808 4.495502 3.878193 8.963013 9.870222 7.581031 2.139246 9.572306 7.202640 8.298533 1.083098 3.395824 2.166010 3.870105 3.411373 8.857978 10.050924 8.959339 7.056924 6.540704 10.570333 4.909146 4.139058 10.926595 6.941619 10.451480 6.186304 8.285001 0.000000 5.882098 5.308721 6.516164 2.700643 5.452145 5.677344 5.315414 4.097739 5.200626 6.554351 5.874225 3.806543 3.744528 3.072959 2.992879 2.565109 4.907652 5.791747 3.570509 2.154234 5.627305 3.313905 4.519079 3.404228 1.082385 3.873179 2.156639 3.404803 6.886863 7.401338 6.529987 4.537059 4.469033 6.645687 3.423337 3.303932 6.822352 3.080658 6.578836 2.523656 4.819688 4.284832 0.000000 10.097656 10.189340 10.664261 4.502429 10.180739 10.436249 9.735934 8.295609 9.994773 10.822587 10.258604 7.965393 7.471921 6.734844 6.140592 5.698633 9.473439 10.079296 8.093459 3.386056 9.447469 7.302734 8.067303 2.142948 3.874969 1.084122 3.392896 2.154122 10.806768 11.795608 10.816063 8.796942 8.000148 11.334988 6.719299 5.630751 11.163253 7.758990 10.141172 6.222902 7.730018 2.491906 4.957279 0.000000 7.860041 7.248429 7.924643 4.576745 7.107761 6.925696 7.510266 6.435416 7.171726 8.859316 7.550036 6.255637 5.915743 5.516317 5.124647 4.883219 5.767881 6.124441 4.537717 3.385844 5.398424 3.507335 4.065219 3.871609 2.143338 3.393908 1.084415 2.152625 9.239032 9.616440 8.887444 6.921030 6.397601 7.784742 5.708954 5.031857 7.178920 4.615360 6.062767 2.592074 3.778098 4.954402 2.473203 4.293608 0.000000 9.779110 9.515104 9.926889 5.251271 9.360288 9.295589 9.479500 8.222265 9.382220 10.761418 9.617896 7.987793 7.486731 6.969039 6.385530 6.078290 8.134066 8.459279 6.858071 3.869726 7.610987 5.788172 6.232646 3.402143 3.404213 2.155899 2.153597 1.083428 10.967584 11.614465 10.789425 8.747258 7.942546 10.141829 7.035474 5.985906 9.518408 6.837427 8.154726 4.787991 5.700657 4.309901 4.299877 2.485656 2.484149 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.8141,-1.605,1.3183;2.6216,-.9727,-2.1399;3.5371,.3786,2.1441;-3.3768,-1.9485,-.0584;3.1009,.0798,-.1185;3.2914,1.3765,-.55;2.312,-2.085,.036;.786,-2.1338,.0659;2.7021,-.9632,-.9424;2.9851,-3.4106,-.2816;3.1777,-.3057,1.2344;.0899,-2.5066,-1.0889;.0696,-1.7203,1.1927;-1.2993,-2.4459,-1.1264;-1.32,-1.6569,1.1589;-1.9963,-2.0044,-.0065;2.2212,2.2857,-.3216;2.4937,3.6565,-.3711;.9124,1.8472,-.1074;-3.9825,-.7051,-.0183;1.4651,4.5764,-.2005;-.1088,2.7793,.0681;.1568,4.1453,.0224;-5.3141,-.677,.3932;-3.3331,.4657,-.4114;-5.9977,.535,.4158;-4.0303,1.673,-.3801;-5.3603,1.7162,.0326;2.6883,-4.1569,.4564;4.0707,-3.2974,-.2642;2.6842,-3.748,-1.2736;.6326,-2.7977,-1.9794;.5949,-1.4393,2.0956;4.1979,1.7219,-.2614;-1.8493,-2.7107,-2.0208;-1.8823,-1.3231,2.0224;3.5088,3.9995,-.543;.6808,.7909,-.0692;1.6901,5.6362,-.2366;-1.1174,2.4261,.2504;-.6408,4.865,.1625;-5.7905,-1.6037,.6886;-2.3037,.4331,-.7442;-7.0325,.556,.7381;-3.5272,2.5818,-.6916;-5.8957,2.6579,.0537; 0.2485959 0.1365625 0.0985981 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= 724 RedAO= T EigKep= 1.07D-06 NBF= 724 NBsUse= 720 1.00D-06 EigRej= 9.94D-07 NBFU= 720 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= 748 748 748 748 748 MxSgAt= 46 MxSgA2= 46. 1 Closed 1 1 1 -1259.96096887287 -1259.96096887267 0.000000000196 -1259.96096887 2 1.254851029082e+03 -8.021169097852e+03 2.963567862175e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 4246732800 LenX= 4245575618 LenY= 4245009362 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. PT1863.400S Wed May 4 03:29:15 2022 -19.20058 -19.17455 -19.14041 -19.13796 -14.42297 -14.38848 -10.35692 -10.31709 -10.28796 -10.25428 -10.24965 -10.23303 -10.21352 -10.20159 -10.20103 -10.19719 -10.19697 -10.19614 -10.18855 -10.18764 -10.18689 -10.18604 -10.18590 -10.18567 -10.18417 -10.18326 -10.18069 -10.17844 -1.16299 -1.09531 -1.09253 -1.07156 -1.04112 -0.90374 -0.89175 -0.86817 -0.85456 -0.83051 -0.77950 -0.77447 -0.76321 -0.76182 -0.75577 -0.74338 -0.70129 -0.66934 -0.66134 -0.64450 -0.63855 -0.63184 -0.62481 -0.60643 -0.60024 -0.57252 -0.56469 -0.55958 -0.53776 -0.51402 -0.50943 -0.50136 -0.49649 -0.48858 -0.48770 -0.47442 -0.47070 -0.45976 -0.45681 -0.45551 -0.45441 -0.44983 -0.44257 -0.44111 -0.43728 -0.43299 -0.43114 -0.42058 -0.41183 -0.40738 -0.40108 -0.39619 -0.38083 -0.37883 -0.37699 -0.37463 -0.36099 -0.35526 -0.34368 -0.34150 -0.33856 -0.32916 -0.31466 -0.29782 -0.28343 -0.27031 -0.26790 -0.26686 -0.24103 -0.23596 -0.05389 -0.04328 -0.02848 -0.02262 -0.02240 -0.01515 -0.01356 -0.00740 0.00001 0.00299 0.01314 0.01592 0.01824 0.01984 0.02429 0.03243 0.03379 0.03634 0.03937 0.04284 0.04443 0.05117 0.05280 0.05553 0.05984 0.06266 0.06529 0.06846 0.07430 0.07630 0.08067 0.08832 0.09059 0.09338 0.09584 0.09750 0.09999 0.10345 0.10490 0.10921 0.11158 0.11547 0.11898 0.12112 0.12322 0.12491 0.12664 0.12872 0.13319 0.13516 0.13593 0.13845 0.14087 0.14292 0.14523 0.14723 0.14988 0.15568 0.15805 0.16012 0.16077 0.16823 0.16917 0.17210 0.17423 0.17897 0.17986 0.18283 0.18484 0.18855 0.18962 0.19170 0.19286 0.19493 0.19788 0.19845 0.20052 0.20484 0.20600 0.20971 0.21118 0.21349 0.21400 0.21732 0.21760 0.22213 0.22382 0.22500 0.22789 0.23009 0.23432 0.23772 0.23989 0.24151 0.24363 0.24468 0.24656 0.25339 0.25385 0.25567 0.25769 0.26044 0.26162 0.26529 0.26574 0.26969 0.27235 0.27632 0.27726 0.27823 0.28098 0.28563 0.28748 0.28881 0.29309 0.29568 0.29836 0.30174 0.30440 0.30849 0.31137 0.31642 0.31886 0.32100 0.32229 0.32578 0.32907 0.33109 0.33389 0.33642 0.33874 0.34121 0.34350 0.34963 0.35285 0.35527 0.35778 0.36325 0.36792 0.36963 0.37241 0.37888 0.38339 0.38464 0.39238 0.39609 0.39843 0.40382 0.40585 0.41206 0.41416 0.42068 0.43119 0.43646 0.44824 0.45722 0.46278 0.46491 0.47235 0.47948 0.48516 0.49277 0.49719 0.50425 0.51177 0.51851 0.52291 0.52386 0.52845 0.53387 0.53820 0.54044 0.54452 0.54705 0.55019 0.55364 0.56517 0.56613 0.56960 0.57202 0.58031 0.58194 0.58847 0.59956 0.60124 0.60520 0.61106 0.61426 0.61487 0.61958 0.62476 0.62840 0.63681 0.63968 0.64243 0.64461 0.64988 0.65661 0.66115 0.66724 0.67081 0.67979 0.68225 0.68706 0.69297 0.69533 0.69742 0.70279 0.70564 0.70690 0.71118 0.71580 0.71852 0.72226 0.72675 0.73087 0.73339 0.73503 0.74472 0.74595 0.74671 0.75436 0.76089 0.76758 0.77008 0.77378 0.78132 0.79493 0.80037 0.80285 0.81007 0.81378 0.81713 0.82247 0.82934 0.83519 0.83937 0.84125 0.84626 0.84921 0.85703 0.86349 0.86832 0.87294 0.87526 0.88435 0.88791 0.88972 0.90009 0.90410 0.91088 0.91247 0.92470 0.92926 0.93096 0.93366 0.94161 0.94776 0.96073 0.96594 0.97597 0.98812 0.99029 0.99537 1.00784 1.01259 1.01502 1.02700 1.03010 1.03834 1.04240 1.04978 1.05710 1.05897 1.06415 1.07105 1.07442 1.08693 1.09174 1.09699 1.09960 1.11273 1.11399 1.12291 1.12872 1.13698 1.14146 1.14823 1.15897 1.16106 1.17243 1.18621 1.19249 1.20265 1.21277 1.21737 1.22122 1.23963 1.25874 1.26309 1.27517 1.28323 1.29808 1.30807 1.31524 1.32539 1.33685 1.34960 1.35374 1.36134 1.38352 1.39118 1.40030 1.41212 1.42130 1.42459 1.45871 1.46309 1.46603 1.47766 1.49344 1.49758 1.50125 1.50922 1.51373 1.52129 1.52271 1.53140 1.53395 1.54536 1.54724 1.55273 1.56117 1.56362 1.56591 1.56899 1.56939 1.57697 1.57985 1.58334 1.59170 1.59657 1.60207 1.61130 1.62832 1.63769 1.64271 1.64772 1.65032 1.66015 1.66744 1.67468 1.68666 1.69219 1.69873 1.70736 1.71067 1.72804 1.73570 1.74168 1.74287 1.74537 1.75626 1.77023 1.77692 1.77959 1.78904 1.79486 1.79633 1.79955 1.81567 1.81934 1.83103 1.84043 1.84835 1.85480 1.87408 1.87892 1.88510 1.88871 1.90012 1.91111 1.91238 1.92060 1.92394 1.93133 1.93884 1.94564 1.94602 1.95598 1.95743 1.96375 1.97092 1.97560 1.98154 1.98361 1.98707 1.99326 1.99448 2.00472 2.00812 2.02408 2.03312 2.03938 2.05163 2.05756 2.06807 2.06893 2.07818 2.07977 2.08450 2.09436 2.10953 2.11696 2.12010 2.13668 2.14184 2.14873 2.18462 2.19115 2.23384 2.24439 2.26067 2.27225 2.28294 2.29542 2.31830 2.33115 2.33946 2.34196 2.35263 2.38530 2.39174 2.39725 2.40053 2.41496 2.42553 2.42745 2.43180 2.43641 2.47207 2.47742 2.48436 2.50086 2.50896 2.55019 2.55088 2.57073 2.59902 2.61718 2.62113 2.62533 2.63294 2.63612 2.64715 2.65745 2.66398 2.67281 2.68036 2.68465 2.69146 2.69387 2.70115 2.70396 2.71013 2.71964 2.72480 2.72844 2.73852 2.74948 2.75370 2.75881 2.76400 2.76570 2.77159 2.78328 2.78725 2.79112 2.79942 2.80899 2.81629 2.82169 2.82977 2.83717 2.83861 2.85440 2.86035 2.86371 2.87791 2.88086 2.88559 2.89178 2.89244 2.90223 2.90706 2.91137 2.92723 2.93182 2.93483 2.94432 2.94923 2.95666 2.97385 2.97744 2.99455 3.00678 3.02778 3.04384 3.06637 3.07665 3.08479 3.09448 3.10260 3.10738 3.12259 3.14622 3.15545 3.16895 3.19088 3.20517 3.21782 3.22119 3.23375 3.30887 3.31365 3.32977 3.34011 3.35705 3.36431 3.37549 3.38155 3.39243 3.42090 3.43288 3.44894 3.48100 3.49586 3.50820 3.51745 3.52200 3.53114 3.53746 3.55811 3.57750 3.59288 3.62000 3.63134 3.65008 3.67374 3.68788 3.77175 3.80470 3.81173 3.84333 3.85239 3.96066 3.97311 3.98785 3.99421 4.01322 4.02539 4.02868 4.04568 4.07849 4.11180 4.11693 4.14927 4.15376 4.16103 4.16718 4.18819 4.20036 4.22025 4.23811 4.32119 4.34302 4.82722 4.83716 4.84071 4.85037 4.88892 5.09241 5.12573 5.13914 5.15973 5.17433 5.21949 5.32014 5.44317 5.44805 5.72642 5.82232 5.87576 5.92623 23.60032 23.61214 23.62978 23.77411 23.87239 23.90474 23.93259 23.94933 23.95320 23.95825 23.96301 23.97166 23.97290 24.05269 24.06734 24.06935 24.09028 24.09518 24.09663 24.17594 24.18982 24.19425 35.49288 35.57104 49.92603 49.98335 50.00418 50.07365 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H 0.022696 -0.220437 -0.260271 0.024511 -0.180777 0.094942 0.173116 0.389615 0.129669 -0.328842 0.201627 -0.221823 -0.225286 -0.245257 -0.077277 -0.466566 -0.208426 -0.517717 0.393202 -0.645760 -0.040259 -0.067939 -0.419509 -0.340698 0.843169 -0.188699 -0.180558 -0.174550 0.178628 0.165057 0.180852 0.147708 0.152052 0.246171 0.140199 0.140166 0.107626 0.212467 0.128616 0.130344 0.125003 0.128883 0.161272 0.131231 0.136041 0.125785 -0.00000 -0.4764 -0.1699 -0.3219 0.5995 -152.0542 -148.2751 -178.9767 -4.9895 -7.1772 0.1092 7.7145 11.4935 -19.2080 -4.9895 -7.1772 0.1092 19.7892 28.3913 5.1417 44.1729 23.1855 0.6175 -35.2655 -27.0211 -15.4775 -4.8032 -8221.0922 -4541.4708 -989.9502 -14.6320 -252.4053 -47.7975 25.7519 6.6642 9.1250 -2115.3355 -1884.1801 -1009.6432 -34.9767 -19.3892 16.0172 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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-BELVIS8 APULGAR 2022-05-04T00:00:00.000 0 Wavefunction famoxadone CONF42 gas 0 1 Version=EM64L-G16RevC.01 State=1-A HF=-1259.9609689 RMSD=6.751e-09 Dipole=-0.1904702,0.0015244,-0.1391349 Quadrupole=4.8895924,8.2430102,-13.1326026,-1.9290265,-4.8300599,6.1609124 PG=C01 [X(C22H18N2O4)] 0 2.3574662129 -2.4103718007 0.9367571513 0 2.4594287878 -1.0079215496 -2.2910623583 0 3.4107270814 -0.8426289096 2.1904917949 0 -3.708086094 -1.1975521836 -0.5048043771 0 3.0351541202 -0.5432688335 -0.0828642129 0 3.4943364675 0.7516897968 -0.210672086 0 1.8346124878 -2.486378208 -0.4226118362 0 0.3285384881 -2.2344207025 -0.4100401323 0 2.4820147405 -1.2781732278 -1.1219105213 0 2.2523317744 -3.8169217003 -1.027993032 0 2.9699756289 -1.2241050396 1.1487433944 0 -0.3697388354 -2.1972346523 -1.6216718303 0 -0.3478089653 -1.9440590166 0.7782796333 0 -1.7172962014 -1.8531515503 -1.6497128781 0 -1.6954316157 -1.5980888936 0.754537301 0 -2.3688617418 -1.5384364869 -0.4617399109 0 2.61112253 1.7835398428 0.2125609859 0 3.1465336058 3.048804889 0.4739215229 0 1.2333098287 1.5795680761 0.3177731351 0 -4.0622592403 0.1019869395 -0.1880576114 0 2.3089951414 4.0953296055 0.8434205162 0 0.4050954271 2.6351966341 0.6947323418 0 0.9326118147 3.8963832556 0.9587187758 0 -5.3815006563 0.3046608042 0.2143321785 0 -3.1797125467 1.1764054287 -0.3050752174 0 -5.8171144774 1.5936358492 0.5066643221 0 -3.6300345547 2.4616956258 -0.0054403475 0 -4.9448074671 2.678216014 0.4015297579 0 1.7808931287 -4.6323182917 -0.478019775 0 3.3370909204 -3.9297706248 -0.9815656418 0 1.9401490435 -3.8608098994 -2.0715623946 0 0.1486531317 -2.3879296397 -2.5528307541 0 0.1775647736 -1.9792588073 1.7232132809 0 4.4356037776 0.8366583769 0.1515949977 0 -2.2641728026 -1.7993742538 -2.5827576594 0 -2.2235286368 -1.3568125368 1.6688977074 0 4.216013749 3.2111165738 0.3873273677 0 0.7995097389 0.6088862056 0.1162832807 0 2.7368503501 5.0702478847 1.0476616812 0 -0.6604525026 2.4596009869 0.7891760931 0 0.2840354146 4.7122724595 1.2543341985 0 -6.0424595611 -0.5498771035 0.291790183 0 -2.1612721622 1.012522168 -0.632915756 0 -6.8426574565 1.7498110006 0.8216127192 0 -2.9456618389 3.2972677835 -0.1024414276 0 -5.2876992497 3.6797528934 0.6321059136 Gaussian 16 4-May-2022 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 132 C1[X(C22H18N2O4)] RB3LYP TD-FC 6-311+G(d,p) SP #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read td=(singlets,nstates=10) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/famoxadone/gas/CONF #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read td 1/29=2,38=1,172=1/1 2/12=2,40=1/2 3/5=4,6=6,7=111,11=9,14=-4,25=1,30=1,74=-5,116=-2,124=31/1,2,3,8 4/5=1/1 5/5=2,38=6/2 8/6=1,10=2,108=10/1 9/41=10,42=1,48=1,70=2/14 6/7=2,8=2,9=2,10=2/1 99/5=1,9=1/99 Electronic spectrum famoxadone CONF42 gas 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 16 16 16 16 14 14 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.9949146 15.9949146 15.9949146 15.9949146 14.0030740 14.0030740 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5.6000000 5.6000000 5.6000000 5.6000000 4.5500000 4.5500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 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 752 A 724 A 724 1152 752 98 98 2542.8422922998 46 46 46 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=131 Grimme-D3 -0.0530545778 0.000000 3.520807 0.000000 2.266942 4.584388 0.000000 6.351374 6.423777 7.620242 0.000000 2.232703 2.328841 2.323536 6.788034 0.000000 3.550733 2.914668 2.883475 7.467325 1.379892 0.000000 1.458437 2.463196 3.466174 5.691163 2.309200 3.644816 0.000000 2.441592 3.095681 4.266115 4.168743 3.208240 4.356476 1.527056 0.000000 2.352764 1.200193 3.467595 6.221308 1.387683 2.444482 1.538801 2.461428 0.000000 2.418611 3.086862 4.532873 6.531570 3.496124 4.804456 1.520303 2.566545 2.550847 0.000000 1.351789 3.484201 1.193744 6.879784 1.408774 2.454940 2.313340 3.229200 2.323123 3.460620 0.000000 3.745482 3.141137 5.537099 3.659415 4.086175 5.061438 2.525968 1.398937 3.037587 3.138645 4.447007 0.000000 2.749741 4.263543 4.163422 3.673560 3.761412 4.796579 2.549356 1.397805 3.473043 3.678446 3.415153 2.413368 0.000000 4.858396 4.309382 6.485750 2.388278 5.172677 6.001429 3.810880 2.422312 4.271228 4.472234 5.495232 1.391075 2.789069 0.000000 4.137510 5.185252 5.357755 2.407727 4.918570 5.778130 3.825696 2.420251 4.590693 4.866772 4.696944 2.786181 1.391526 2.417841 0.000000 5.005421 5.190400 6.397041 1.382598 5.507930 6.299588 4.309213 2.786222 4.902506 5.183393 5.585306 2.403321 2.405584 1.390994 1.391545 0.000000 4.263531 3.752785 3.383540 7.023811 2.383509 1.422641 4.386184 4.662813 3.342390 5.747423 3.170353 5.300614 4.792735 5.952209 5.502323 6.024156 0.000000 5.535292 4.957245 4.261416 8.122516 3.636676 2.422060 5.758746 6.052682 4.659507 7.084740 4.329471 6.654067 6.101783 7.224669 6.716919 7.234489 1.398524 0.000000 4.191240 3.873563 3.757028 5.727689 2.813110 2.465133 4.176321 3.986833 3.434915 5.654343 3.401044 4.538221 3.889467 4.935650 4.343477 4.827549 1.396797 2.417326 0.000000 6.984986 6.941681 7.899071 1.383680 7.127461 7.584508 6.444203 4.978673 6.753106 7.479131 7.279965 4.579997 4.349397 3.384945 3.062779 2.373497 6.893630 7.815923 5.521065 0.000000 6.506551 5.990892 5.235633 8.126351 4.785594 3.700821 6.719133 6.749749 5.724246 8.130752 5.369032 7.269708 6.598262 7.603365 6.961203 7.438085 2.415292 1.390401 2.786119 7.589705 0.000000 5.415541 5.138829 4.833879 5.748662 4.198155 3.729714 5.433462 4.993952 4.788345 6.928917 4.656065 5.414655 4.641490 5.490559 4.726150 5.143100 2.413372 2.781243 1.393696 5.210924 2.403941 0.000000 6.465744 6.078195 5.487855 7.044583 5.021562 4.221256 6.592520 6.310718 5.788411 8.073646 5.514196 6.744384 5.981873 6.847122 6.094057 6.515727 2.799689 2.419683 2.422574 6.376620 1.395458 1.392320 0.000000 8.233159 8.335469 9.084313 2.360957 8.464478 8.897244 7.763239 6.280233 8.131776 8.763915 8.541511 5.894756 5.541916 4.642975 4.183226 3.595841 8.128291 8.962426 6.737344 1.394056 8.597014 6.256746 7.302232 0.000000 6.713231 6.365166 7.330638 2.440235 6.452226 6.688215 6.210737 4.894137 6.224736 7.413706 6.759786 4.583757 4.350935 3.622834 3.320194 2.837673 5.845539 6.643351 4.474958 1.395334 6.321793 3.997316 5.089859 2.424375 0.000000 9.112674 9.115731 9.691425 3.641675 9.125599 9.376917 8.721181 7.298179 8.931690 9.835917 9.250129 6.969535 6.519384 5.773977 5.218890 4.757954 8.435505 9.081056 7.052968 2.405654 8.509144 6.311586 7.146034 1.391644 2.790859 0.000000 7.776564 7.371830 8.081646 3.693988 7.311672 7.329591 7.383755 6.155283 7.251915 8.664230 7.647052 5.911630 5.549585 4.998010 4.560932 4.218984 6.281677 6.818824 4.953255 2.405908 6.217829 4.099100 4.879106 2.787245 1.394468 2.408132 0.000000 8.916468 8.698297 9.241845 4.168033 8.619303 8.677871 8.562288 7.252642 8.551700 9.799447 8.856084 6.985314 6.529913 5.929394 5.382364 5.016063 7.611060 8.100147 6.275602 2.786299 7.404129 5.358104 6.028138 2.420642 2.422867 1.395810 1.393246 0.000000 2.696493 4.108988 4.913152 6.475124 4.295305 5.656404 2.147327 2.804259 3.486611 1.090686 3.959317 3.444240 3.651903 4.618870 4.776042 5.176180 6.506106 7.859441 6.286546 7.525965 8.842903 7.488988 8.690371 8.726569 7.640601 9.872276 8.934568 9.972591 0.000000 2.635944 3.319981 4.426942 7.571449 3.516706 4.747112 2.157140 3.500320 2.789591 1.091601 3.463180 4.141498 4.540770 5.505052 5.811805 6.208590 5.881742 7.131288 6.038790 8.463753 8.293961 7.382775 8.413971 9.765983 8.306588 10.794551 9.504972 10.684956 1.780136 0.000000 3.365696 2.908058 5.425599 6.438185 4.019955 5.210908 2.149241 2.828973 2.804544 1.090147 4.287555 2.881921 4.126777 4.193513 5.130711 5.152914 6.125856 7.461744 5.983833 7.435069 8.481352 7.225433 8.388789 8.728288 7.396418 9.827175 8.675822 9.812119 1.777629 1.773216 0.000000 4.129962 2.704187 5.960553 4.526129 4.223197 5.151360 2.718452 2.155800 2.953586 2.965234 4.797499 1.082660 3.397027 2.140882 3.868227 3.381151 5.577841 6.906996 5.015764 5.433564 7.631137 5.987005 7.241420 6.744615 5.369814 7.797676 6.654814 7.767716 3.465015 3.874569 2.368640 0.000000 2.357189 4.718560 3.458846 4.546802 3.672846 4.711578 2.758177 2.153757 3.727833 3.905227 2.949209 3.396367 1.081738 3.870792 2.142834 3.384174 4.728946 5.971342 3.969271 5.095159 6.497511 4.733154 5.973083 6.196468 5.034231 7.083908 6.099847 7.048235 3.801949 4.593793 4.587729 4.295626 0.000000 3.934252 3.643394 2.833280 8.419534 1.980007 1.012147 4.258807 5.158968 3.148149 5.273890 2.718293 5.953176 5.568318 6.952551 6.624283 7.233119 2.056461 2.580540 3.291537 8.536321 3.952218 4.446879 4.720627 9.831709 7.636558 10.286755 8.229212 9.562736 6.111760 5.020919 5.765061 6.007481 5.341373 0.000000 5.841220 4.798322 7.476882 2.600955 5.992506 6.730167 4.683828 3.410589 4.993197 5.185229 6.453785 2.161217 3.871686 1.082838 3.391389 2.139571 6.664802 7.881870 5.662395 3.547235 8.209756 6.126365 7.429882 4.687047 3.857631 5.803485 5.163803 6.011704 5.368245 6.202948 4.710325 2.483752 4.953365 7.701452 0.000000 4.757261 6.142727 5.681662 2.637092 5.602166 6.377503 4.703067 3.406644 5.471465 5.775698 5.221174 3.869198 2.157865 3.393494 1.083123 2.143298 5.946140 7.048049 4.732610 2.992876 7.138000 4.877991 6.169412 3.853445 3.350828 4.792681 4.400304 5.029218 5.601213 6.675744 6.131660 4.951105 2.481056 7.173393 4.274820 0.000000 5.946192 5.297136 4.509184 9.111730 3.963700 2.631958 6.228043 6.738111 5.043637 7.433203 4.669428 7.369903 6.896170 8.062289 7.629449 8.163318 2.155039 1.085187 3.400487 8.861578 2.150947 3.866430 3.402471 10.029441 7.701704 10.163373 7.891538 9.176319 8.258215 7.323841 7.825461 7.519127 6.710712 2.396214 8.713165 7.998506 0.000000 3.495186 3.341364 3.636990 4.895650 2.522940 2.718342 3.307946 2.929714 2.815127 4.796648 3.022706 3.501706 2.876127 3.938868 3.391584 3.870876 2.161255 3.404354 1.082129 4.897588 3.868147 2.143852 3.396329 6.189269 4.041513 6.700884 4.802976 6.112338 5.365308 5.314508 5.105478 4.065549 3.109266 3.643392 4.740326 3.925983 4.303204 0.000000 7.491055 6.940330 6.059891 9.123194 5.733990 4.561484 7.751022 7.828349 6.713750 9.139195 6.299480 8.342214 7.667346 8.663066 8.012351 8.486536 3.393472 2.140853 3.870170 8.511082 1.084085 3.389855 2.154332 9.450549 7.210938 9.249315 6.960660 8.071380 9.868199 9.245452 9.493581 8.676792 7.530064 4.648869 9.240232 8.142383 2.465834 4.952222 0.000000 5.731165 5.589744 5.426132 4.933277 4.840991 4.602057 5.670669 4.944700 5.243883 7.154100 5.184495 5.251935 4.414758 5.066057 4.187747 4.524130 3.390095 3.865190 2.140798 4.252719 3.390600 1.084041 2.151962 5.221351 3.031608 5.236494 3.074059 4.307408 7.606660 7.742089 7.409085 5.943250 4.612827 5.386116 5.663985 4.216886 4.950372 2.451412 4.292314 0.000000 7.425095 7.072679 6.442788 7.345586 6.080910 5.304573 7.552285 7.143435 6.809045 9.046014 6.516594 7.512664 6.703179 7.452759 6.632401 7.003866 3.883053 3.401480 3.404718 6.498115 2.156370 2.154543 1.083381 7.253064 5.189573 6.892673 4.687438 5.674985 9.620967 9.434262 9.343556 8.057649 6.708783 5.785494 7.976101 6.579782 4.297165 4.289365 2.487400 2.486555 0.000000 8.627640 8.897361 9.646425 2.550166 9.085344 9.638310 8.143014 6.627207 8.671541 9.012157 9.078157 6.209258 5.882981 4.916808 4.495502 3.878193 8.963013 9.870222 7.581031 2.139246 9.572306 7.202640 8.298533 1.083098 3.395824 2.166010 3.870105 3.411373 8.857978 10.050924 8.959339 7.056924 6.540704 10.570333 4.909146 4.139058 10.926595 6.941619 10.451480 6.186304 8.285001 0.000000 5.882098 5.308721 6.516164 2.700643 5.452145 5.677344 5.315414 4.097739 5.200626 6.554351 5.874225 3.806543 3.744528 3.072959 2.992879 2.565109 4.907652 5.791747 3.570509 2.154234 5.627305 3.313905 4.519079 3.404228 1.082385 3.873179 2.156639 3.404803 6.886863 7.401338 6.529987 4.537059 4.469033 6.645687 3.423337 3.303932 6.822352 3.080658 6.578836 2.523656 4.819688 4.284832 0.000000 10.097656 10.189340 10.664261 4.502429 10.180739 10.436249 9.735934 8.295609 9.994773 10.822587 10.258604 7.965393 7.471921 6.734844 6.140592 5.698633 9.473439 10.079296 8.093459 3.386056 9.447469 7.302734 8.067303 2.142948 3.874969 1.084122 3.392896 2.154122 10.806768 11.795608 10.816063 8.796942 8.000148 11.334988 6.719299 5.630751 11.163253 7.758990 10.141172 6.222902 7.730018 2.491906 4.957279 0.000000 7.860041 7.248429 7.924643 4.576745 7.107761 6.925696 7.510266 6.435416 7.171726 8.859316 7.550036 6.255637 5.915743 5.516317 5.124647 4.883219 5.767881 6.124441 4.537717 3.385844 5.398424 3.507335 4.065219 3.871609 2.143338 3.393908 1.084415 2.152625 9.239032 9.616440 8.887444 6.921030 6.397601 7.784742 5.708954 5.031857 7.178920 4.615360 6.062767 2.592074 3.778098 4.954402 2.473203 4.293608 0.000000 9.779110 9.515104 9.926889 5.251271 9.360288 9.295589 9.479500 8.222265 9.382220 10.761418 9.617896 7.987793 7.486731 6.969039 6.385530 6.078290 8.134066 8.459279 6.858071 3.869726 7.610987 5.788172 6.232646 3.402143 3.404213 2.155899 2.153597 1.083428 10.967584 11.614465 10.789425 8.747258 7.942546 10.141829 7.035474 5.985906 9.518408 6.837427 8.154726 4.787991 5.700657 4.309901 4.299877 2.485656 2.484149 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.8141,-1.605,1.3183;2.6216,-.9727,-2.1399;3.5371,.3786,2.1441;-3.3768,-1.9485,-.0584;3.1009,.0798,-.1185;3.2914,1.3765,-.55;2.312,-2.085,.036;.786,-2.1338,.0659;2.7021,-.9632,-.9424;2.9851,-3.4106,-.2816;3.1777,-.3057,1.2344;.0899,-2.5066,-1.0889;.0696,-1.7203,1.1927;-1.2993,-2.4459,-1.1264;-1.32,-1.6569,1.1589;-1.9963,-2.0044,-.0065;2.2212,2.2857,-.3216;2.4937,3.6565,-.3711;.9124,1.8472,-.1074;-3.9825,-.7051,-.0183;1.4651,4.5764,-.2005;-.1088,2.7793,.0681;.1568,4.1453,.0224;-5.3141,-.677,.3932;-3.3331,.4657,-.4114;-5.9977,.535,.4158;-4.0303,1.673,-.3801;-5.3603,1.7162,.0326;2.6883,-4.1569,.4564;4.0707,-3.2974,-.2642;2.6842,-3.748,-1.2736;.6326,-2.7977,-1.9794;.5949,-1.4393,2.0956;4.1979,1.7219,-.2614;-1.8493,-2.7107,-2.0208;-1.8823,-1.3231,2.0224;3.5088,3.9995,-.543;.6808,.7909,-.0692;1.6901,5.6362,-.2366;-1.1174,2.4261,.2504;-.6408,4.865,.1625;-5.7905,-1.6037,.6886;-2.3037,.4331,-.7442;-7.0325,.556,.7381;-3.5272,2.5818,-.6916;-5.8957,2.6579,.0537; 0.2485959 0.1365625 0.0985981 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= 724 RedAO= T EigKep= 1.07D-06 NBF= 724 NBsUse= 720 1.00D-06 EigRej= 9.94D-07 NBFU= 720 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= 748 748 748 748 748 MxSgAt= 46 MxSgA2= 46. 1 Closed 1 1 1 -1259.96096887286 -1259.96096887 1 1.254851028047e+03 -8.021169097919e+03 2.963567863277e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 4246732800 LenX= 4245575618 LenY= 4245009362 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. 1 Singlet-A 4.2528 291.54 0.0051 0.000 98 99 0.69184 -1259.80468284 2 Singlet-A 4.5098 274.92 0.0561 0.000 97 99 0.68775 3 Singlet-A 4.6581 266.17 0.0180 0.000 93 99 0.10269 97 100 0.59025 98 100 -0.33568 4 Singlet-A 4.7315 262.04 0.0177 0.000 97 100 0.33339 98 100 0.60022 98 101 -0.12054 5 Singlet-A 4.9381 251.07 0.0230 0.000 95 104 0.23181 98 100 0.14262 98 101 0.56526 98 102 0.12887 98 103 0.25422 6 Singlet-A 4.9990 248.02 0.0301 0.000 92 99 -0.31083 92 103 0.10953 94 99 0.33076 96 99 0.39279 97 101 -0.14058 98 103 -0.18617 7 Singlet-A 5.1049 242.87 0.0218 0.000 93 99 0.20971 94 100 -0.14409 94 105 0.15223 96 100 -0.13502 96 105 -0.15751 97 101 -0.27540 97 102 0.47391 98 102 -0.11532 8 Singlet-A 5.1498 240.75 0.0025 0.000 94 99 0.11495 96 99 0.13084 97 101 -0.10421 98 101 -0.29572 98 103 0.56705 9 Singlet-A 5.1831 239.21 0.0003 0.000 93 99 -0.28614 94 100 0.25448 95 99 -0.21882 96 99 -0.24621 96 100 0.33612 97 100 0.12321 97 101 -0.21627 97 102 0.12871 10 Singlet-A 5.2546 235.95 0.0019 0.000 93 99 -0.10714 94 99 0.11912 95 99 0.65353 PT66382.100S Wed May 4 04:15:31 2022 -19.20058 -19.17455 -19.14041 -19.13796 -14.42297 -14.38848 -10.35692 -10.31709 -10.28796 -10.25428 -10.24965 -10.23303 -10.21352 -10.20159 -10.20103 -10.19719 -10.19697 -10.19614 -10.18855 -10.18764 -10.18689 -10.18604 -10.18590 -10.18567 -10.18417 -10.18326 -10.18069 -10.17844 -1.16299 -1.09531 -1.09253 -1.07156 -1.04112 -0.90374 -0.89175 -0.86817 -0.85456 -0.83051 -0.77950 -0.77447 -0.76321 -0.76182 -0.75577 -0.74338 -0.70129 -0.66934 -0.66134 -0.64450 -0.63855 -0.63184 -0.62481 -0.60643 -0.60024 -0.57252 -0.56469 -0.55958 -0.53776 -0.51402 -0.50943 -0.50136 -0.49649 -0.48858 -0.48770 -0.47442 -0.47070 -0.45976 -0.45681 -0.45551 -0.45441 -0.44983 -0.44257 -0.44111 -0.43728 -0.43299 -0.43114 -0.42058 -0.41183 -0.40738 -0.40108 -0.39619 -0.38083 -0.37883 -0.37699 -0.37463 -0.36099 -0.35526 -0.34368 -0.34150 -0.33856 -0.32916 -0.31466 -0.29782 -0.28343 -0.27031 -0.26790 -0.26686 -0.24103 -0.23596 -0.05389 -0.04328 -0.02848 -0.02262 -0.02240 -0.01515 -0.01356 -0.00740 0.00001 0.00299 0.01314 0.01592 0.01824 0.01984 0.02429 0.03243 0.03379 0.03634 0.03937 0.04284 0.04443 0.05117 0.05280 0.05553 0.05984 0.06266 0.06529 0.06846 0.07430 0.07630 0.08067 0.08832 0.09059 0.09338 0.09584 0.09750 0.09999 0.10345 0.10490 0.10921 0.11158 0.11547 0.11898 0.12112 0.12322 0.12491 0.12664 0.12872 0.13319 0.13516 0.13593 0.13845 0.14087 0.14292 0.14523 0.14723 0.14988 0.15568 0.15805 0.16012 0.16077 0.16823 0.16917 0.17210 0.17423 0.17897 0.17986 0.18283 0.18484 0.18855 0.18962 0.19170 0.19286 0.19493 0.19788 0.19845 0.20052 0.20484 0.20600 0.20971 0.21118 0.21349 0.21400 0.21732 0.21760 0.22213 0.22382 0.22500 0.22789 0.23009 0.23432 0.23772 0.23989 0.24151 0.24363 0.24468 0.24656 0.25339 0.25385 0.25567 0.25769 0.26044 0.26162 0.26529 0.26574 0.26969 0.27235 0.27632 0.27726 0.27823 0.28098 0.28563 0.28748 0.28881 0.29309 0.29568 0.29836 0.30174 0.30440 0.30849 0.31137 0.31642 0.31886 0.32100 0.32229 0.32578 0.32907 0.33109 0.33389 0.33642 0.33874 0.34121 0.34350 0.34963 0.35285 0.35527 0.35778 0.36325 0.36792 0.36963 0.37241 0.37888 0.38339 0.38464 0.39238 0.39609 0.39843 0.40382 0.40585 0.41206 0.41416 0.42068 0.43119 0.43646 0.44824 0.45722 0.46278 0.46491 0.47235 0.47948 0.48516 0.49277 0.49719 0.50425 0.51177 0.51851 0.52291 0.52386 0.52845 0.53387 0.53820 0.54044 0.54452 0.54705 0.55019 0.55364 0.56517 0.56613 0.56960 0.57202 0.58031 0.58194 0.58847 0.59956 0.60124 0.60520 0.61106 0.61426 0.61487 0.61958 0.62476 0.62840 0.63681 0.63968 0.64243 0.64461 0.64988 0.65661 0.66115 0.66724 0.67081 0.67979 0.68225 0.68706 0.69297 0.69533 0.69742 0.70279 0.70564 0.70690 0.71118 0.71580 0.71852 0.72226 0.72675 0.73087 0.73339 0.73503 0.74472 0.74595 0.74671 0.75436 0.76089 0.76758 0.77008 0.77378 0.78132 0.79493 0.80037 0.80285 0.81007 0.81378 0.81713 0.82247 0.82934 0.83519 0.83937 0.84125 0.84626 0.84921 0.85703 0.86349 0.86832 0.87294 0.87526 0.88435 0.88791 0.88972 0.90009 0.90410 0.91088 0.91247 0.92470 0.92926 0.93096 0.93366 0.94161 0.94776 0.96073 0.96594 0.97597 0.98812 0.99029 0.99537 1.00784 1.01259 1.01502 1.02700 1.03010 1.03834 1.04240 1.04978 1.05710 1.05897 1.06415 1.07105 1.07442 1.08693 1.09174 1.09699 1.09960 1.11273 1.11399 1.12291 1.12872 1.13698 1.14146 1.14823 1.15897 1.16106 1.17243 1.18621 1.19249 1.20265 1.21277 1.21737 1.22122 1.23963 1.25874 1.26309 1.27517 1.28323 1.29808 1.30807 1.31524 1.32539 1.33685 1.34960 1.35374 1.36134 1.38352 1.39118 1.40030 1.41212 1.42130 1.42459 1.45871 1.46309 1.46603 1.47766 1.49344 1.49758 1.50125 1.50922 1.51373 1.52129 1.52271 1.53140 1.53395 1.54536 1.54724 1.55273 1.56117 1.56362 1.56591 1.56899 1.56939 1.57697 1.57985 1.58334 1.59170 1.59657 1.60207 1.61130 1.62832 1.63769 1.64271 1.64772 1.65032 1.66015 1.66744 1.67468 1.68666 1.69219 1.69873 1.70736 1.71067 1.72804 1.73570 1.74168 1.74287 1.74537 1.75626 1.77023 1.77692 1.77959 1.78904 1.79486 1.79633 1.79955 1.81567 1.81934 1.83103 1.84043 1.84835 1.85480 1.87408 1.87892 1.88510 1.88871 1.90012 1.91111 1.91238 1.92060 1.92394 1.93133 1.93884 1.94564 1.94602 1.95598 1.95743 1.96375 1.97092 1.97560 1.98154 1.98361 1.98707 1.99326 1.99448 2.00472 2.00812 2.02408 2.03312 2.03938 2.05163 2.05756 2.06807 2.06893 2.07818 2.07977 2.08450 2.09436 2.10953 2.11696 2.12010 2.13668 2.14184 2.14873 2.18462 2.19115 2.23384 2.24439 2.26067 2.27225 2.28294 2.29542 2.31830 2.33115 2.33946 2.34196 2.35263 2.38530 2.39174 2.39725 2.40053 2.41496 2.42553 2.42745 2.43180 2.43641 2.47207 2.47742 2.48436 2.50086 2.50896 2.55019 2.55088 2.57073 2.59902 2.61718 2.62113 2.62533 2.63294 2.63612 2.64715 2.65745 2.66398 2.67281 2.68036 2.68465 2.69146 2.69387 2.70115 2.70396 2.71013 2.71964 2.72480 2.72844 2.73852 2.74948 2.75370 2.75881 2.76400 2.76570 2.77159 2.78328 2.78725 2.79112 2.79942 2.80899 2.81629 2.82169 2.82977 2.83717 2.83861 2.85440 2.86035 2.86371 2.87791 2.88086 2.88559 2.89178 2.89244 2.90223 2.90706 2.91137 2.92723 2.93182 2.93483 2.94432 2.94923 2.95666 2.97385 2.97744 2.99455 3.00678 3.02778 3.04384 3.06637 3.07665 3.08479 3.09448 3.10260 3.10738 3.12259 3.14622 3.15546 3.16895 3.19088 3.20517 3.21782 3.22119 3.23375 3.30887 3.31365 3.32977 3.34011 3.35705 3.36431 3.37549 3.38155 3.39243 3.42090 3.43288 3.44894 3.48100 3.49586 3.50820 3.51745 3.52200 3.53114 3.53746 3.55811 3.57750 3.59288 3.62000 3.63134 3.65008 3.67374 3.68788 3.77175 3.80470 3.81173 3.84333 3.85239 3.96066 3.97311 3.98785 3.99421 4.01322 4.02539 4.02868 4.04568 4.07849 4.11180 4.11693 4.14927 4.15376 4.16103 4.16718 4.18819 4.20036 4.22025 4.23811 4.32119 4.34302 4.82722 4.83716 4.84071 4.85037 4.88892 5.09241 5.12573 5.13914 5.15973 5.17433 5.21949 5.32014 5.44317 5.44805 5.72642 5.82232 5.87576 5.92623 23.60032 23.61214 23.62978 23.77411 23.87239 23.90474 23.93259 23.94933 23.95320 23.95825 23.96301 23.97166 23.97290 24.05269 24.06734 24.06935 24.09028 24.09518 24.09663 24.17594 24.18982 24.19425 35.49288 35.57104 49.92603 49.98335 50.00418 50.07365 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H 0.022696 -0.220437 -0.260271 0.024511 -0.180777 0.094942 0.173116 0.389615 0.129669 -0.328842 0.201626 -0.221823 -0.225286 -0.245257 -0.077277 -0.466565 -0.208426 -0.517717 0.393202 -0.645760 -0.040259 -0.067939 -0.419509 -0.340698 0.843169 -0.188699 -0.180558 -0.174550 0.178628 0.165057 0.180852 0.147708 0.152052 0.246171 0.140199 0.140166 0.107626 0.212467 0.128616 0.130344 0.125003 0.128883 0.161272 0.131231 0.136041 0.125785 -0.00000 -0.4764 -0.1699 -0.3219 0.5995 -152.0542 -148.2751 -178.9767 -4.9894 -7.1771 0.1092 7.7145 11.4936 -19.2080 -4.9894 -7.1771 0.1092 19.7894 28.3914 5.1417 44.1729 23.1855 0.6175 -35.2655 -27.0211 -15.4775 -4.8032 -8221.0934 -4541.4707 -989.9502 -14.6317 -252.4051 -47.7974 25.7519 6.6643 9.1250 -2115.3355 -1884.1801 -1009.6432 -34.9767 -19.3892 16.0172 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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-BELVIS8 APULGAR 2022-05-04T00:00:00.000 0 Electronic spectrum famoxadone CONF42 gas 0 1 Version=EM64L-G16RevC.01 State=1-A HF=-1259.9609689 RMSD=9.941e-09 PG=C01 [X(C22H18N2O4)] 0 2.3574662129 -2.4103718007 0.9367571513 0 2.4594287878 -1.0079215496 -2.2910623583 0 3.4107270814 -0.8426289096 2.1904917949 0 -3.708086094 -1.1975521836 -0.5048043771 0 3.0351541202 -0.5432688335 -0.0828642129 0 3.4943364675 0.7516897968 -0.210672086 0 1.8346124878 -2.486378208 -0.4226118362 0 0.3285384881 -2.2344207025 -0.4100401323 0 2.4820147405 -1.2781732278 -1.1219105213 0 2.2523317744 -3.8169217003 -1.027993032 0 2.9699756289 -1.2241050396 1.1487433944 0 -0.3697388354 -2.1972346523 -1.6216718303 0 -0.3478089653 -1.9440590166 0.7782796333 0 -1.7172962014 -1.8531515503 -1.6497128781 0 -1.6954316157 -1.5980888936 0.754537301 0 -2.3688617418 -1.5384364869 -0.4617399109 0 2.61112253 1.7835398428 0.2125609859 0 3.1465336058 3.048804889 0.4739215229 0 1.2333098287 1.5795680761 0.3177731351 0 -4.0622592403 0.1019869395 -0.1880576114 0 2.3089951414 4.0953296055 0.8434205162 0 0.4050954271 2.6351966341 0.6947323418 0 0.9326118147 3.8963832556 0.9587187758 0 -5.3815006563 0.3046608042 0.2143321785 0 -3.1797125467 1.1764054287 -0.3050752174 0 -5.8171144774 1.5936358492 0.5066643221 0 -3.6300345547 2.4616956258 -0.0054403475 0 -4.9448074671 2.678216014 0.4015297579 0 1.7808931287 -4.6323182917 -0.478019775 0 3.3370909204 -3.9297706248 -0.9815656418 0 1.9401490435 -3.8608098994 -2.0715623946 0 0.1486531317 -2.3879296397 -2.5528307541 0 0.1775647736 -1.9792588073 1.7232132809 0 4.4356037776 0.8366583769 0.1515949977 0 -2.2641728026 -1.7993742538 -2.5827576594 0 -2.2235286368 -1.3568125368 1.6688977074 0 4.216013749 3.2111165738 0.3873273677 0 0.7995097389 0.6088862056 0.1162832807 0 2.7368503501 5.0702478847 1.0476616812 0 -0.6604525026 2.4596009869 0.7891760931 0 0.2840354146 4.7122724595 1.2543341985 0 -6.0424595611 -0.5498771035 0.291790183 0 -2.1612721622 1.012522168 -0.632915756 0 -6.8426574565 1.7498110006 0.8216127192 0 -2.9456618389 3.2972677835 -0.1024414276 0 -5.2876992497 3.6797528934 0.6321059136 Gaussian 16 4-May-2022 Gaussian 16 3-Jul-2019 EM64L-G16RevC.01 132 C1[X(C22H18N2O4)] RB3LYP 6-311+G(3df,2p) SP #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.3575,-2.4104,.9368;2.4594,-1.0079,-2.2911;3.4107,-.8426,2.1905;-3.7081,-1.1976,-.5048;3.0352,-.5433,-.0829;3.4943,.7517,-.2107;1.8346,-2.4864,-.4226;.3285,-2.2344,-.41;2.482,-1.2782,-1.1219;2.2523,-3.8169,-1.028;2.97,-1.2241,1.1487;-.3697,-2.1972,-1.6217;-.3478,-1.9441,.7783;-1.7173,-1.8532,-1.6497;-1.6954,-1.5981,.7545;-2.3689,-1.5384,-.4617;2.6111,1.7835,.2126;3.1465,3.0488,.4739;1.2333,1.5796,.3178;-4.0623,.102,-.1881;2.309,4.0953,.8434;.4051,2.6352,.6947;.9326,3.8964,.9587;-5.3815,.3047,.2143;-3.1797,1.1764,-.3051;-5.8171,1.5936,.5067;-3.63,2.4617,-.0054;-4.9448,2.6782,.4015;1.7809,-4.6323,-.478;3.3371,-3.9298,-.9816;1.9401,-3.8608,-2.0716;.1487,-2.3879,-2.5528;.1776,-1.9793,1.7232;4.4356,.8367,.1516;-2.2642,-1.7994,-2.5828;-2.2235,-1.3568,1.6689;4.216,3.2111,.3873;.7995,.6089,.1163;2.7369,5.0702,1.0477;-.6605,2.4596,.7892;.284,4.7123,1.2543;-6.0425,-.5499,.2918;-2.1613,1.0125,-.6329;-6.8427,1.7498,.8216;-2.9457,3.2973,-.1024;-5.2877,3.6798,.6321; oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/famoxadone/gas/CONF #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 geom=check guess=read 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=1,74=-5,116=-2,124=31/1,2,3 4/5=1/1 5/5=2,38=6/2 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,9=1/99 Single Point famoxadone CONF42 gas 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 16 16 16 16 14 14 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 15.9949146 15.9949146 15.9949146 15.9949146 14.0030740 14.0030740 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5.6000000 5.6000000 5.6000000 5.6000000 4.5500000 4.5500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 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 1422 A 1254 A 1254 1822 1422 98 98 2542.8422922998 46 46 46 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=131 Grimme-D3 -0.0530545778 0.000000 3.520807 0.000000 2.266942 4.584388 0.000000 6.351374 6.423777 7.620242 0.000000 2.232703 2.328841 2.323536 6.788034 0.000000 3.550733 2.914668 2.883475 7.467325 1.379892 0.000000 1.458437 2.463196 3.466174 5.691163 2.309200 3.644816 0.000000 2.441592 3.095681 4.266115 4.168743 3.208240 4.356476 1.527056 0.000000 2.352764 1.200193 3.467595 6.221308 1.387683 2.444482 1.538801 2.461428 0.000000 2.418611 3.086862 4.532873 6.531570 3.496124 4.804456 1.520303 2.566545 2.550847 0.000000 1.351789 3.484201 1.193744 6.879784 1.408774 2.454940 2.313340 3.229200 2.323123 3.460620 0.000000 3.745482 3.141137 5.537099 3.659415 4.086175 5.061438 2.525968 1.398937 3.037587 3.138645 4.447007 0.000000 2.749741 4.263543 4.163422 3.673560 3.761412 4.796579 2.549356 1.397805 3.473043 3.678446 3.415153 2.413368 0.000000 4.858396 4.309382 6.485750 2.388278 5.172677 6.001429 3.810880 2.422312 4.271228 4.472234 5.495232 1.391075 2.789069 0.000000 4.137510 5.185252 5.357755 2.407727 4.918570 5.778130 3.825696 2.420251 4.590693 4.866772 4.696944 2.786181 1.391526 2.417841 0.000000 5.005421 5.190400 6.397041 1.382598 5.507930 6.299588 4.309213 2.786222 4.902506 5.183393 5.585306 2.403321 2.405584 1.390994 1.391545 0.000000 4.263531 3.752785 3.383540 7.023811 2.383509 1.422641 4.386184 4.662813 3.342390 5.747423 3.170353 5.300614 4.792735 5.952209 5.502323 6.024156 0.000000 5.535292 4.957245 4.261416 8.122516 3.636676 2.422060 5.758746 6.052682 4.659507 7.084740 4.329471 6.654067 6.101783 7.224669 6.716919 7.234489 1.398524 0.000000 4.191240 3.873563 3.757028 5.727689 2.813110 2.465133 4.176321 3.986833 3.434915 5.654343 3.401044 4.538221 3.889467 4.935650 4.343477 4.827549 1.396797 2.417326 0.000000 6.984986 6.941681 7.899071 1.383680 7.127461 7.584508 6.444203 4.978673 6.753106 7.479131 7.279965 4.579997 4.349397 3.384945 3.062779 2.373497 6.893630 7.815923 5.521065 0.000000 6.506551 5.990892 5.235633 8.126351 4.785594 3.700821 6.719133 6.749749 5.724246 8.130752 5.369032 7.269708 6.598262 7.603365 6.961203 7.438085 2.415292 1.390401 2.786119 7.589705 0.000000 5.415541 5.138829 4.833879 5.748662 4.198155 3.729714 5.433462 4.993952 4.788345 6.928917 4.656065 5.414655 4.641490 5.490559 4.726150 5.143100 2.413372 2.781243 1.393696 5.210924 2.403941 0.000000 6.465744 6.078195 5.487855 7.044583 5.021562 4.221256 6.592520 6.310718 5.788411 8.073646 5.514196 6.744384 5.981873 6.847122 6.094057 6.515727 2.799689 2.419683 2.422574 6.376620 1.395458 1.392320 0.000000 8.233159 8.335469 9.084313 2.360957 8.464478 8.897244 7.763239 6.280233 8.131776 8.763915 8.541511 5.894756 5.541916 4.642975 4.183226 3.595841 8.128291 8.962426 6.737344 1.394056 8.597014 6.256746 7.302232 0.000000 6.713231 6.365166 7.330638 2.440235 6.452226 6.688215 6.210737 4.894137 6.224736 7.413706 6.759786 4.583757 4.350935 3.622834 3.320194 2.837673 5.845539 6.643351 4.474958 1.395334 6.321793 3.997316 5.089859 2.424375 0.000000 9.112674 9.115731 9.691425 3.641675 9.125599 9.376917 8.721181 7.298179 8.931690 9.835917 9.250129 6.969535 6.519384 5.773977 5.218890 4.757954 8.435505 9.081056 7.052968 2.405654 8.509144 6.311586 7.146034 1.391644 2.790859 0.000000 7.776564 7.371830 8.081646 3.693988 7.311672 7.329591 7.383755 6.155283 7.251915 8.664230 7.647052 5.911630 5.549585 4.998010 4.560932 4.218984 6.281677 6.818824 4.953255 2.405908 6.217829 4.099100 4.879106 2.787245 1.394468 2.408132 0.000000 8.916468 8.698297 9.241845 4.168033 8.619303 8.677871 8.562288 7.252642 8.551700 9.799447 8.856084 6.985314 6.529913 5.929394 5.382364 5.016063 7.611060 8.100147 6.275602 2.786299 7.404129 5.358104 6.028138 2.420642 2.422867 1.395810 1.393246 0.000000 2.696493 4.108988 4.913152 6.475124 4.295305 5.656404 2.147327 2.804259 3.486611 1.090686 3.959317 3.444240 3.651903 4.618870 4.776042 5.176180 6.506106 7.859441 6.286546 7.525965 8.842903 7.488988 8.690371 8.726569 7.640601 9.872276 8.934568 9.972591 0.000000 2.635944 3.319981 4.426942 7.571449 3.516706 4.747112 2.157140 3.500320 2.789591 1.091601 3.463180 4.141498 4.540770 5.505052 5.811805 6.208590 5.881742 7.131288 6.038790 8.463753 8.293961 7.382775 8.413971 9.765983 8.306588 10.794551 9.504972 10.684956 1.780136 0.000000 3.365696 2.908058 5.425599 6.438185 4.019955 5.210908 2.149241 2.828973 2.804544 1.090147 4.287555 2.881921 4.126777 4.193513 5.130711 5.152914 6.125856 7.461744 5.983833 7.435069 8.481352 7.225433 8.388789 8.728288 7.396418 9.827175 8.675822 9.812119 1.777629 1.773216 0.000000 4.129962 2.704187 5.960553 4.526129 4.223197 5.151360 2.718452 2.155800 2.953586 2.965234 4.797499 1.082660 3.397027 2.140882 3.868227 3.381151 5.577841 6.906996 5.015764 5.433564 7.631137 5.987005 7.241420 6.744615 5.369814 7.797676 6.654814 7.767716 3.465015 3.874569 2.368640 0.000000 2.357189 4.718560 3.458846 4.546802 3.672846 4.711578 2.758177 2.153757 3.727833 3.905227 2.949209 3.396367 1.081738 3.870792 2.142834 3.384174 4.728946 5.971342 3.969271 5.095159 6.497511 4.733154 5.973083 6.196468 5.034231 7.083908 6.099847 7.048235 3.801949 4.593793 4.587729 4.295626 0.000000 3.934252 3.643394 2.833280 8.419534 1.980007 1.012147 4.258807 5.158968 3.148149 5.273890 2.718293 5.953176 5.568318 6.952551 6.624283 7.233119 2.056461 2.580540 3.291537 8.536321 3.952218 4.446879 4.720627 9.831709 7.636558 10.286755 8.229212 9.562736 6.111760 5.020919 5.765061 6.007481 5.341373 0.000000 5.841220 4.798322 7.476882 2.600955 5.992506 6.730167 4.683828 3.410589 4.993197 5.185229 6.453785 2.161217 3.871686 1.082838 3.391389 2.139571 6.664802 7.881870 5.662395 3.547235 8.209756 6.126365 7.429882 4.687047 3.857631 5.803485 5.163803 6.011704 5.368245 6.202948 4.710325 2.483752 4.953365 7.701452 0.000000 4.757261 6.142727 5.681662 2.637092 5.602166 6.377503 4.703067 3.406644 5.471465 5.775698 5.221174 3.869198 2.157865 3.393494 1.083123 2.143298 5.946140 7.048049 4.732610 2.992876 7.138000 4.877991 6.169412 3.853445 3.350828 4.792681 4.400304 5.029218 5.601213 6.675744 6.131660 4.951105 2.481056 7.173393 4.274820 0.000000 5.946192 5.297136 4.509184 9.111730 3.963700 2.631958 6.228043 6.738111 5.043637 7.433203 4.669428 7.369903 6.896170 8.062289 7.629449 8.163318 2.155039 1.085187 3.400487 8.861578 2.150947 3.866430 3.402471 10.029441 7.701704 10.163373 7.891538 9.176319 8.258215 7.323841 7.825461 7.519127 6.710712 2.396214 8.713165 7.998506 0.000000 3.495186 3.341364 3.636990 4.895650 2.522940 2.718342 3.307946 2.929714 2.815127 4.796648 3.022706 3.501706 2.876127 3.938868 3.391584 3.870876 2.161255 3.404354 1.082129 4.897588 3.868147 2.143852 3.396329 6.189269 4.041513 6.700884 4.802976 6.112338 5.365308 5.314508 5.105478 4.065549 3.109266 3.643392 4.740326 3.925983 4.303204 0.000000 7.491055 6.940330 6.059891 9.123194 5.733990 4.561484 7.751022 7.828349 6.713750 9.139195 6.299480 8.342214 7.667346 8.663066 8.012351 8.486536 3.393472 2.140853 3.870170 8.511082 1.084085 3.389855 2.154332 9.450549 7.210938 9.249315 6.960660 8.071380 9.868199 9.245452 9.493581 8.676792 7.530064 4.648869 9.240232 8.142383 2.465834 4.952222 0.000000 5.731165 5.589744 5.426132 4.933277 4.840991 4.602057 5.670669 4.944700 5.243883 7.154100 5.184495 5.251935 4.414758 5.066057 4.187747 4.524130 3.390095 3.865190 2.140798 4.252719 3.390600 1.084041 2.151962 5.221351 3.031608 5.236494 3.074059 4.307408 7.606660 7.742089 7.409085 5.943250 4.612827 5.386116 5.663985 4.216886 4.950372 2.451412 4.292314 0.000000 7.425095 7.072679 6.442788 7.345586 6.080910 5.304573 7.552285 7.143435 6.809045 9.046014 6.516594 7.512664 6.703179 7.452759 6.632401 7.003866 3.883053 3.401480 3.404718 6.498115 2.156370 2.154543 1.083381 7.253064 5.189573 6.892673 4.687438 5.674985 9.620967 9.434262 9.343556 8.057649 6.708783 5.785494 7.976101 6.579782 4.297165 4.289365 2.487400 2.486555 0.000000 8.627640 8.897361 9.646425 2.550166 9.085344 9.638310 8.143014 6.627207 8.671541 9.012157 9.078157 6.209258 5.882981 4.916808 4.495502 3.878193 8.963013 9.870222 7.581031 2.139246 9.572306 7.202640 8.298533 1.083098 3.395824 2.166010 3.870105 3.411373 8.857978 10.050924 8.959339 7.056924 6.540704 10.570333 4.909146 4.139058 10.926595 6.941619 10.451480 6.186304 8.285001 0.000000 5.882098 5.308721 6.516164 2.700643 5.452145 5.677344 5.315414 4.097739 5.200626 6.554351 5.874225 3.806543 3.744528 3.072959 2.992879 2.565109 4.907652 5.791747 3.570509 2.154234 5.627305 3.313905 4.519079 3.404228 1.082385 3.873179 2.156639 3.404803 6.886863 7.401338 6.529987 4.537059 4.469033 6.645687 3.423337 3.303932 6.822352 3.080658 6.578836 2.523656 4.819688 4.284832 0.000000 10.097656 10.189340 10.664261 4.502429 10.180739 10.436249 9.735934 8.295609 9.994773 10.822587 10.258604 7.965393 7.471921 6.734844 6.140592 5.698633 9.473439 10.079296 8.093459 3.386056 9.447469 7.302734 8.067303 2.142948 3.874969 1.084122 3.392896 2.154122 10.806768 11.795608 10.816063 8.796942 8.000148 11.334988 6.719299 5.630751 11.163253 7.758990 10.141172 6.222902 7.730018 2.491906 4.957279 0.000000 7.860041 7.248429 7.924643 4.576745 7.107761 6.925696 7.510266 6.435416 7.171726 8.859316 7.550036 6.255637 5.915743 5.516317 5.124647 4.883219 5.767881 6.124441 4.537717 3.385844 5.398424 3.507335 4.065219 3.871609 2.143338 3.393908 1.084415 2.152625 9.239032 9.616440 8.887444 6.921030 6.397601 7.784742 5.708954 5.031857 7.178920 4.615360 6.062767 2.592074 3.778098 4.954402 2.473203 4.293608 0.000000 9.779110 9.515104 9.926889 5.251271 9.360288 9.295589 9.479500 8.222265 9.382220 10.761418 9.617896 7.987793 7.486731 6.969039 6.385530 6.078290 8.134066 8.459279 6.858071 3.869726 7.610987 5.788172 6.232646 3.402143 3.404213 2.155899 2.153597 1.083428 10.967584 11.614465 10.789425 8.747258 7.942546 10.141829 7.035474 5.985906 9.518408 6.837427 8.154726 4.787991 5.700657 4.309901 4.299877 2.485656 2.484149 0.000000 C22H18N2O4 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 0 356.2463999999997 AuxInfo=1/0/N:7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;5;6;1;2;3;4;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46/rA:46nO0O0O0O0N0N0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0C0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0H0/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rC:2.8141,-1.605,1.3183;2.6216,-.9727,-2.1399;3.5371,.3786,2.1441;-3.3768,-1.9485,-.0584;3.1009,.0798,-.1185;3.2914,1.3765,-.55;2.312,-2.085,.036;.786,-2.1338,.0659;2.7021,-.9632,-.9424;2.9851,-3.4106,-.2816;3.1777,-.3057,1.2344;.0899,-2.5066,-1.0889;.0696,-1.7203,1.1927;-1.2993,-2.4459,-1.1264;-1.32,-1.6569,1.1589;-1.9963,-2.0044,-.0065;2.2212,2.2857,-.3216;2.4937,3.6565,-.3711;.9124,1.8472,-.1074;-3.9825,-.7051,-.0183;1.4651,4.5764,-.2005;-.1088,2.7793,.0681;.1568,4.1453,.0224;-5.3141,-.677,.3932;-3.3331,.4657,-.4114;-5.9977,.535,.4158;-4.0303,1.673,-.3801;-5.3603,1.7162,.0326;2.6883,-4.1569,.4564;4.0707,-3.2974,-.2642;2.6842,-3.748,-1.2736;.6326,-2.7977,-1.9794;.5949,-1.4393,2.0956;4.1979,1.7219,-.2614;-1.8493,-2.7107,-2.0208;-1.8823,-1.3231,2.0224;3.5088,3.9995,-.543;.6808,.7909,-.0692;1.6901,5.6362,-.2366;-1.1174,2.4261,.2504;-.6408,4.865,.1625;-5.7905,-1.6037,.6886;-2.3037,.4331,-.7442;-7.0325,.556,.7381;-3.5272,2.5818,-.6916;-5.8957,2.6579,.0537; 0.2485959 0.1365625 0.0985981 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= 1254 RedAO= T EigKep= 1.08D-06 NBF= 1254 NBsUse= 1248 1.00D-06 EigRej= 9.34D-07 NBFU= 1248 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= 1397 1397 1397 1397 1397 MxSgAt= 46 MxSgA2= 46. 1 Closed 1 1 1 -1259.96631690721 -1260.05143277368 -0.085115866478 -1260.05124951909 0.000183254599 -1260.05181807393 -0.000568554840 -1260.05188601829 -0.000067944368 -1260.05189392777 -0.000007909481 -1260.05189485723 -0.000000929459 -1260.05189493898 -0.000000081749 -1260.05189495572 -0.000000016742 -1260.05189495641 -0.000000000684 -1260.05189495681 -0.000000000401 -1260.05189495675 0.000000000063 -1260.05189496 12 1.254421632385e+03 -8.021277338357e+03 2.964014573293e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 4246732800 LenX= 4242641726 LenY= 4240618220 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. PT66569.300S Wed May 4 05:01:48 2022 -19.19959 -19.17436 -19.13815 -19.13573 -14.42059 -14.38694 -10.35276 -10.31324 -10.28538 -10.25198 -10.24780 -10.23133 -10.21134 -10.19958 -10.19912 -10.19511 -10.19492 -10.19419 -10.18683 -10.18609 -10.18537 -10.18444 -10.18435 -10.18388 -10.18255 -10.18161 -10.17897 -10.17686 -1.15828 -1.09224 -1.08790 -1.06700 -1.03728 -0.90077 -0.88926 -0.86603 -0.85230 -0.82794 -0.77739 -0.77225 -0.76142 -0.76003 -0.75363 -0.74147 -0.69865 -0.66660 -0.65875 -0.64219 -0.63611 -0.63000 -0.62306 -0.60434 -0.59838 -0.57032 -0.56274 -0.55747 -0.53568 -0.51236 -0.50771 -0.49961 -0.49468 -0.48706 -0.48615 -0.47262 -0.46905 -0.45785 -0.45521 -0.45382 -0.45279 -0.44816 -0.44112 -0.43942 -0.43625 -0.43141 -0.42985 -0.41986 -0.41060 -0.40652 -0.40066 -0.39481 -0.37982 -0.37735 -0.37555 -0.37315 -0.35942 -0.35408 -0.34289 -0.34095 -0.33762 -0.32784 -0.31330 -0.29650 -0.28284 -0.26977 -0.26770 -0.26626 -0.24058 -0.23564 -0.05266 -0.04320 -0.02847 -0.02274 -0.02172 -0.01534 -0.01333 -0.00805 -0.00074 0.00225 0.01216 0.01484 0.01747 0.01986 0.02392 0.03117 0.03227 0.03553 0.03787 0.04152 0.04306 0.04990 0.05187 0.05484 0.05858 0.06141 0.06366 0.06735 0.07314 0.07484 0.07917 0.08704 0.08924 0.09242 0.09370 0.09576 0.09842 0.10098 0.10345 0.10758 0.11048 0.11407 0.11752 0.11933 0.12079 0.12352 0.12448 0.12643 0.13163 0.13348 0.13432 0.13599 0.13918 0.14089 0.14296 0.14381 0.14746 0.15335 0.15411 0.15671 0.15836 0.16444 0.16544 0.16788 0.17012 0.17407 0.17694 0.17906 0.18100 0.18279 0.18556 0.18649 0.18700 0.18971 0.19163 0.19222 0.19303 0.19839 0.20074 0.20153 0.20600 0.20684 0.20886 0.21161 0.21356 0.21560 0.21724 0.21914 0.22284 0.22530 0.22857 0.22904 0.23296 0.23535 0.23612 0.23861 0.23936 0.24385 0.24653 0.24839 0.25085 0.25374 0.25559 0.25887 0.26126 0.26298 0.26494 0.26632 0.26684 0.27038 0.27454 0.27602 0.27974 0.28193 0.28220 0.28672 0.28919 0.29034 0.29563 0.29947 0.30031 0.30270 0.30618 0.30892 0.31099 0.31314 0.31596 0.31892 0.32218 0.32442 0.32611 0.33021 0.33155 0.33323 0.33828 0.34006 0.34350 0.34492 0.34782 0.34857 0.35277 0.35657 0.35899 0.36102 0.36809 0.37021 0.37356 0.37797 0.37841 0.38234 0.38332 0.38782 0.39421 0.39566 0.40049 0.40493 0.40558 0.41197 0.41316 0.41600 0.41780 0.42248 0.42603 0.43142 0.43615 0.43733 0.43883 0.44287 0.44598 0.44897 0.45013 0.45644 0.45835 0.46113 0.46153 0.46395 0.46612 0.47117 0.47270 0.47773 0.47890 0.48332 0.48635 0.49196 0.49711 0.49811 0.50157 0.50502 0.51357 0.51532 0.51684 0.52145 0.52684 0.52832 0.53519 0.53605 0.53807 0.54165 0.54396 0.54837 0.55004 0.55228 0.55277 0.55872 0.56119 0.56410 0.56701 0.56891 0.57044 0.57399 0.57780 0.57849 0.58203 0.58257 0.58769 0.58963 0.59226 0.59625 0.59718 0.59944 0.60101 0.60507 0.60844 0.61042 0.61283 0.61668 0.61838 0.62313 0.62505 0.62745 0.63084 0.63493 0.63637 0.64215 0.64580 0.64783 0.65013 0.65570 0.65805 0.66024 0.66494 0.66851 0.67373 0.67801 0.68090 0.68288 0.68664 0.69201 0.69511 0.69744 0.70396 0.70588 0.71089 0.71614 0.71900 0.72166 0.72687 0.72845 0.73285 0.73854 0.73898 0.74052 0.74553 0.74843 0.75312 0.75594 0.76076 0.76548 0.76648 0.77216 0.77400 0.78162 0.78661 0.79202 0.79512 0.79634 0.79757 0.80258 0.80790 0.81064 0.81541 0.81743 0.82211 0.82599 0.82930 0.84051 0.84255 0.84514 0.84731 0.85262 0.85394 0.85786 0.86229 0.86984 0.87356 0.87766 0.88494 0.88987 0.89555 0.90195 0.90851 0.90894 0.91514 0.92203 0.93087 0.93433 0.93838 0.94182 0.94599 0.95300 0.95554 0.96228 0.96586 0.96808 0.97803 0.98099 0.98688 0.99278 0.99975 1.00495 1.00515 1.01067 1.01527 1.02072 1.02763 1.03507 1.03926 1.04374 1.04893 1.06065 1.06158 1.06840 1.07363 1.07632 1.07753 1.08266 1.08912 1.09364 1.09476 1.09721 1.10213 1.10771 1.11027 1.11998 1.12049 1.12359 1.12785 1.13603 1.14160 1.14286 1.14628 1.14938 1.15344 1.15542 1.16087 1.16504 1.17094 1.17406 1.17562 1.17899 1.18252 1.18648 1.19176 1.19504 1.20014 1.20635 1.20726 1.21208 1.21506 1.21719 1.22044 1.22255 1.22699 1.22955 1.23205 1.23928 1.24137 1.24390 1.24685 1.25092 1.25381 1.25844 1.26058 1.26281 1.27048 1.27268 1.27400 1.27632 1.28030 1.28237 1.28619 1.29562 1.29646 1.30092 1.30356 1.30796 1.31330 1.31488 1.31853 1.31973 1.32252 1.33137 1.33211 1.33692 1.34086 1.34304 1.34796 1.35337 1.35674 1.35937 1.36025 1.36385 1.37228 1.37897 1.38166 1.38584 1.38652 1.39123 1.39442 1.39583 1.39988 1.40856 1.41019 1.41418 1.41968 1.42564 1.43044 1.43204 1.43514 1.43993 1.44589 1.44858 1.45061 1.45477 1.45672 1.46225 1.46880 1.47079 1.47508 1.47979 1.48535 1.48671 1.49209 1.49679 1.50177 1.50606 1.51427 1.51618 1.51950 1.52530 1.52787 1.53504 1.53603 1.54027 1.55168 1.55352 1.55527 1.56152 1.56918 1.57114 1.58108 1.58786 1.58811 1.59168 1.59691 1.60625 1.61930 1.62196 1.62598 1.62987 1.63703 1.64304 1.64827 1.65126 1.65646 1.66095 1.67387 1.67944 1.68571 1.68953 1.70609 1.70768 1.71865 1.72251 1.73351 1.73427 1.74331 1.74433 1.75582 1.76024 1.76278 1.77374 1.78239 1.78576 1.78928 1.80147 1.80817 1.81404 1.81877 1.82957 1.83924 1.84787 1.85700 1.86887 1.87166 1.88280 1.89295 1.89974 1.91089 1.91370 1.92641 1.93062 1.93912 1.94434 1.94971 1.95756 1.95932 1.96874 1.97171 1.97428 1.98330 1.98982 2.00202 2.00388 2.01003 2.01980 2.02644 2.03077 2.03748 2.03980 2.04821 2.05781 2.06731 2.07198 2.07760 2.08633 2.09416 2.09589 2.10558 2.11041 2.11513 2.12771 2.13399 2.14603 2.15621 2.16535 2.17080 2.18019 2.18879 2.19794 2.20325 2.20751 2.21788 2.23126 2.23203 2.24621 2.25447 2.26762 2.27277 2.29179 2.31813 2.33936 2.34471 2.35221 2.35674 2.37501 2.37754 2.38277 2.39670 2.40519 2.41391 2.41785 2.42329 2.43432 2.44145 2.44466 2.45272 2.45563 2.47146 2.47741 2.48295 2.49412 2.51149 2.51963 2.52249 2.52804 2.53999 2.54482 2.55047 2.55689 2.57308 2.58260 2.58825 2.60366 2.62415 2.63176 2.63812 2.64286 2.65179 2.65987 2.66810 2.68847 2.70489 2.71484 2.73397 2.73785 2.75164 2.75877 2.76728 2.77486 2.77956 2.79130 2.79867 2.80505 2.80695 2.81179 2.81495 2.81761 2.82215 2.82627 2.83383 2.83718 2.84087 2.84800 2.85158 2.85289 2.85446 2.86852 2.87594 2.87791 2.88137 2.88786 2.89118 2.89405 2.89845 2.90770 2.91148 2.91363 2.92515 2.92795 2.93193 2.93531 2.93782 2.94198 2.94735 2.95468 2.95942 2.96279 2.96788 2.97422 2.98522 2.99201 2.99475 3.00461 3.01662 3.01736 3.02855 3.03809 3.04466 3.04977 3.05353 3.06400 3.07664 3.08008 3.08282 3.09134 3.09695 3.10720 3.11038 3.11890 3.12565 3.12807 3.13276 3.14587 3.15105 3.15767 3.16413 3.17644 3.18293 3.18941 3.20013 3.20127 3.21042 3.22159 3.23196 3.23344 3.24485 3.24931 3.25406 3.25942 3.26368 3.26552 3.27101 3.27340 3.27691 3.28055 3.28661 3.28965 3.29076 3.30477 3.30957 3.31010 3.32059 3.32721 3.33268 3.33771 3.34821 3.35291 3.35894 3.36950 3.37627 3.37962 3.38733 3.39368 3.39818 3.40373 3.40798 3.41401 3.41793 3.42429 3.42902 3.43966 3.44471 3.45435 3.45820 3.45936 3.47189 3.48142 3.48827 3.49320 3.50566 3.50637 3.51665 3.52238 3.53430 3.54643 3.54948 3.55926 3.56222 3.56568 3.57005 3.58152 3.58740 3.59619 3.59851 3.59927 3.61683 3.61979 3.62665 3.63801 3.63964 3.64910 3.65790 3.67016 3.67700 3.68525 3.68617 3.69120 3.70065 3.70183 3.70982 3.72364 3.72843 3.73102 3.73742 3.74541 3.76074 3.76330 3.77712 3.77954 3.78949 3.79107 3.79736 3.80145 3.80450 3.81204 3.82406 3.82721 3.83230 3.83971 3.85755 3.86741 3.87822 3.88890 3.89707 3.91377 3.92151 3.93412 3.94263 3.94772 3.96725 3.97701 3.98780 3.99838 4.01796 4.02467 4.04217 4.05963 4.06924 4.08399 4.09634 4.10074 4.11060 4.11866 4.13340 4.14281 4.15231 4.16110 4.16428 4.17713 4.18373 4.18752 4.20618 4.20785 4.21699 4.21984 4.22817 4.23651 4.24925 4.25695 4.26435 4.27052 4.27339 4.28868 4.29270 4.29762 4.30925 4.31732 4.32566 4.32805 4.33533 4.34024 4.34190 4.34654 4.34917 4.35680 4.36266 4.37054 4.37433 4.38152 4.38748 4.39563 4.40228 4.41056 4.42060 4.42829 4.44118 4.45817 4.45995 4.46952 4.47641 4.48227 4.48476 4.49631 4.49826 4.50685 4.52217 4.53253 4.54229 4.55240 4.55494 4.55815 4.56412 4.56729 4.57236 4.57682 4.57799 4.58826 4.59180 4.60261 4.62374 4.63137 4.63474 4.65408 4.67020 4.67809 4.68101 4.68846 4.70447 4.71215 4.72705 4.74099 4.75281 4.76125 4.76471 4.78527 4.78687 4.80261 4.82740 4.83237 4.84531 4.86983 4.87168 4.88859 4.89821 4.92398 4.94128 4.94860 4.97422 4.99102 5.01245 5.02376 5.05263 5.07171 5.07508 5.08220 5.09902 5.11873 5.13852 5.16461 5.20842 5.23645 5.26889 5.31325 5.32296 5.33490 5.34206 5.36666 5.38259 5.42127 5.43517 5.44478 5.46545 5.47297 5.50160 5.52013 5.52968 5.53616 5.56089 5.56602 5.57873 5.61440 5.61835 5.63000 5.63670 5.66793 5.68420 5.72278 5.75220 5.77673 5.78309 5.78716 5.81186 5.81657 5.84201 5.85320 5.90279 5.91188 5.92370 5.93642 5.94711 5.94971 5.95467 5.96248 5.97848 5.99005 6.00532 6.02437 6.04270 6.07398 6.10891 6.16211 6.18510 6.19758 6.20865 6.29467 6.34842 6.36426 6.39080 6.41138 6.43725 6.45483 6.62844 6.65188 6.67237 6.69652 6.77751 6.78292 6.81040 6.90468 7.04119 7.08388 7.08469 7.10126 7.11111 7.11519 7.13237 7.14562 7.15664 7.16698 7.17406 7.17957 7.18807 7.19169 7.19948 7.21680 7.25325 7.25958 7.26741 7.27365 7.28938 7.29835 7.29957 7.30860 7.31469 7.31744 7.32328 7.33267 7.33627 7.35204 7.36440 7.37598 7.38199 7.38607 7.39516 7.41597 7.42990 7.43138 7.43916 7.45081 7.45960 7.46633 7.47992 7.48406 7.49324 7.50242 7.51952 7.53149 7.54109 7.55357 7.57139 7.57947 7.60610 7.61863 7.63133 7.63275 7.64364 7.65099 7.66921 7.67248 7.68568 7.70865 7.73750 7.81984 7.84963 7.85949 7.86529 7.86630 7.89827 7.90719 7.91316 7.92952 7.93384 7.95123 7.95742 7.96226 7.97226 7.97803 7.99135 8.01562 8.02821 8.03647 8.06812 8.09998 8.11543 8.12214 8.13090 8.17985 8.20901 8.27201 8.28300 8.28983 8.29509 8.29683 8.31505 8.33116 8.37878 8.40587 8.45646 8.45843 8.46132 8.46434 8.47661 8.57506 8.58865 8.63230 8.70066 8.72242 8.89591 9.37632 9.38410 9.38880 10.33319 10.51041 10.54976 10.61933 10.66846 10.82832 10.98792 11.30695 11.43310 11.87101 14.38653 14.41372 14.43335 14.43992 14.45011 14.46486 14.50982 14.52300 14.58192 14.64016 14.70159 14.70994 14.74630 14.85976 14.99195 15.03456 15.10441 15.13044 15.15144 15.22362 24.00100 24.00836 24.06810 24.35832 24.50460 24.95347 24.95757 24.95803 24.97354 24.98808 24.99239 25.16200 25.21218 25.36115 25.37665 25.37820 25.40347 25.41236 25.41645 25.79529 25.80224 25.80538 35.99517 36.14037 50.29637 50.30335 50.49492 50.54607 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 O O O O N N C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H -0.646910 -0.764172 -0.768392 -0.761908 -0.352030 -0.660327 0.201732 0.296548 1.126301 -0.377131 1.276257 -0.155111 -0.183257 -0.357923 -0.230367 0.241298 0.643130 -0.522229 -0.256762 0.450370 -0.079879 0.177439 -0.509737 -0.113988 -0.229422 -0.088228 0.025156 -0.448461 0.164393 0.163391 0.179108 0.155122 0.168285 0.228785 0.151161 0.152391 0.123347 0.364167 0.132887 0.197917 0.133523 0.139535 0.202102 0.132252 0.146911 0.132725 -0.00000 -0.4542 -0.3061 -0.3070 0.6279 -152.0663 -148.2156 -178.2012 -4.5898 -6.9020 -0.1373 7.4281 11.2787 -18.7068 -4.5898 -6.9020 -0.1373 22.9463 24.0487 5.2294 43.4206 20.2389 -0.1308 -34.0433 -26.3495 -14.5404 -5.3512 -8239.1361 -4552.2039 -986.4742 -8.0650 -242.9169 -44.0593 24.3674 7.2642 7.6132 -2116.3540 -1875.0877 -1006.4192 -35.5876 -17.4145 15.6022 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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-BELVIS8 APULGAR 2022-05-04T00:00:00.000 0 Single Point famoxadone CONF42 gas 0 1 Version=EM64L-G16RevC.01 State=1-A HF=-1260.051895 RMSD=4.289e-09 Dipole=-0.192607,-0.0526882,-0.1454425 Quadrupole=4.7770357,8.0883398,-12.8653754,-1.6722789,-4.6270816,5.8331667 PG=C01 [X(C22H18N2O4)] 0 2.3574662129 -2.4103718007 0.9367571513 0 2.4594287878 -1.0079215496 -2.2910623583 0 3.4107270814 -0.8426289096 2.1904917949 0 -3.708086094 -1.1975521836 -0.5048043771 0 3.0351541202 -0.5432688335 -0.0828642129 0 3.4943364675 0.7516897968 -0.210672086 0 1.8346124878 -2.486378208 -0.4226118362 0 0.3285384881 -2.2344207025 -0.4100401323 0 2.4820147405 -1.2781732278 -1.1219105213 0 2.2523317744 -3.8169217003 -1.027993032 0 2.9699756289 -1.2241050396 1.1487433944 0 -0.3697388354 -2.1972346523 -1.6216718303 0 -0.3478089653 -1.9440590166 0.7782796333 0 -1.7172962014 -1.8531515503 -1.6497128781 0 -1.6954316157 -1.5980888936 0.754537301 0 -2.3688617418 -1.5384364869 -0.4617399109 0 2.61112253 1.7835398428 0.2125609859 0 3.1465336058 3.048804889 0.4739215229 0 1.2333098287 1.5795680761 0.3177731351 0 -4.0622592403 0.1019869395 -0.1880576114 0 2.3089951414 4.0953296055 0.8434205162 0 0.4050954271 2.6351966341 0.6947323418 0 0.9326118147 3.8963832556 0.9587187758 0 -5.3815006563 0.3046608042 0.2143321785 0 -3.1797125467 1.1764054287 -0.3050752174 0 -5.8171144774 1.5936358492 0.5066643221 0 -3.6300345547 2.4616956258 -0.0054403475 0 -4.9448074671 2.678216014 0.4015297579 0 1.7808931287 -4.6323182917 -0.478019775 0 3.3370909204 -3.9297706248 -0.9815656418 0 1.9401490435 -3.8608098994 -2.0715623946 0 0.1486531317 -2.3879296397 -2.5528307541 0 0.1775647736 -1.9792588073 1.7232132809 0 4.4356037776 0.8366583769 0.1515949977 0 -2.2641728026 -1.7993742538 -2.5827576594 0 -2.2235286368 -1.3568125368 1.6688977074 0 4.216013749 3.2111165738 0.3873273677 0 0.7995097389 0.6088862056 0.1162832807 0 2.7368503501 5.0702478847 1.0476616812 0 -0.6604525026 2.4596009869 0.7891760931 0 0.2840354146 4.7122724595 1.2543341985 0 -6.0424595611 -0.5498771035 0.291790183 0 -2.1612721622 1.012522168 -0.632915756 0 -6.8426574565 1.7498110006 0.8216127192 0 -2.9456618389 3.2972677835 -0.1024414276 0 -5.2876992497 3.6797528934 0.6321059136