Gaussian 16 GINC-C0312 RABBANI15 Checking optimization ES64L-G16RevC.02 25-Jul-2025 Gaussian 16 7-Dec-2021 ES64L-G16RevC.02 102 102 C1[X(H5Mo7S24)] C1[X(H5Mo7S24)] UM06L Gen/Auto FOpt #p opt freq um06l/gen/auto pseudo=read scf=(xqc,intrep,maxconventionalcycle=350) 1441.140000000001 -1 1 AuxInfo=1/1/N:1;12;17;22;2;27;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;s9;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:-.002,.063,-.815;2.782,2.468,.43;.473,1.803,-1.962;1.026,3.661,1.166;4.267,2.837,1.895;3.159,4.008,-1.424;.526,-3.601,.065;1.34,-1.549,-1.597;2.718,-2.663,1.376;.385,-5.262,1.388;2.192,-4.779,-1.279;-3.655,1.27,.116;-2.042,-.61,-1.467;-3.617,-.94,1.531;-4.52,2.39,1.716;-5.256,.39,-1.025;-2.719,-2.868,.089;-.45,-1.864,1.198;-1.208,-3.879,-1.444;-4.505,-2.879,-1.085;-2.92,-4.321,1.648;-1.172,3.774,-.027;-1.212,1.419,1.032;-2.892,2.881,-1.391;-.358,5.153,-1.473;-2.241,4.891,1.433;3.965,-.823,.042;1.862,.363,1.065;3.931,1.1,-1.256;4.788,-2.241,-1.35;5.427,-.461,1.551;3.512,-3.677,.97;2.602,-3.785,-2.095;2.444,5.053,-.953;-2.557,-.685,2.329;-.265,-1.547,2.456;/R:/0/N:7,17,27,1,12,2,22,11,18,10,20,21,9,30,31,3,8,13,15,16,6,5,25,26,19,14,29,24,4,28,23/E:(8,9)(11,12)(14,15)(16,17,18)(19,20)(23,24)/CRV:10.1,11.1,12.1,14.1,15.1,16.1,17.1,18.1,19.1,20.1,22.1,23.1,24.1,26.3,30.3,31.3 g16 H 0 nprocshared=28 mem=110gb chk=01.chk #p opt freq um06l/gen/auto pseudo=read scf=(xqc,intrep,maxconventional 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=7,11=2,16=1,17=8,25=1,30=1,71=1,74=-53,82=28,116=2/1,2,3 4//1 5/5=2,8=3,13=1,17=20,38=5,85=350/2,8 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=7,6=1,11=2,16=1,17=8,25=1,30=1,71=1,74=-53,82=7,116=2/1,2,3 4/5=5,16=3,69=1/1 5/5=2,8=3,13=1,17=20,38=5,85=350/2,8 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 Checking optimization 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 98 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 1 1 1 1 1 97.9055000 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 0 0 0 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 -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 /apps/gaussian/g16c02/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 1 1 1 1 1 2 2 2 2 2 4 6 7 7 7 7 7 9 9 11 12 12 12 12 12 14 14 17 17 17 17 18 22 22 22 22 27 27 27 27 3 8 13 23 28 4 5 6 28 29 22 34 9 10 11 18 19 27 32 33 14 15 16 23 24 17 35 18 19 20 21 36 23 24 25 26 28 29 30 31 2.1375 2.2385 2.2449 2.5912 2.6644 2.2469 2.1184 2.4395 2.3834 2.4565 2.5034 1.351 2.7209 2.1282 2.4433 2.292 2.3154 2.5923 1.3504 1.3498 2.6245 2.136 2.1539 2.6133 2.3342 2.5696 1.3511 2.7178 2.3781 2.1373 2.1406 1.3104 2.5825 2.3699 2.1576 2.1265 2.6222 2.3203 2.1507 2.132 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|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 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 3 3 3 3 8 8 8 13 13 23 4 4 4 4 5 5 5 6 6 28 2 2 9 9 9 9 10 10 10 11 11 18 7 7 27 7 14 14 14 14 15 15 15 16 16 23 12 12 17 14 14 14 14 18 18 18 19 19 20 7 7 17 7 4 4 4 4 23 23 23 24 24 25 1 1 12 12 9 9 9 9 28 28 28 29 29 30 1 1 2 2 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 4 6 7 7 7 7 7 7 7 7 7 7 9 9 9 11 12 12 12 12 12 12 12 12 12 12 14 14 14 17 17 17 17 17 17 17 17 17 17 18 18 18 19 22 22 22 22 22 22 22 22 22 22 23 23 23 24 27 27 27 27 27 27 27 27 27 27 28 28 28 29 8 13 23 28 13 23 28 23 28 28 5 6 28 29 6 28 29 28 29 29 22 34 10 11 18 19 11 18 19 18 19 19 27 32 32 33 15 16 23 24 16 23 24 23 24 24 17 35 35 18 19 20 21 19 20 21 20 21 21 17 36 36 17 23 24 25 26 24 25 26 25 26 26 12 22 22 22 28 29 30 31 29 30 31 30 31 31 2 27 27 27 105.398 106.8657 93.4554 97.5569 103.1462 154.9311 84.7308 86.535 150.9776 76.3972 103.2284 91.9795 94.5882 152.3835 107.896 103.8971 104.1091 145.0525 75.9745 82.6209 123.6447 98.1378 91.3125 83.2193 81.003 163.48 90.621 104.831 105.1782 158.0728 95.4089 95.4083 112.5985 94.0117 95.4757 100.6383 92.4953 87.268 81.1119 157.5981 108.06 94.9402 104.7196 154.6633 100.5408 83.1871 109.5309 99.8387 101.4716 77.6194 154.5251 91.1506 93.8863 83.6635 157.47 91.8317 100.0592 103.9208 108.5473 82.752 126.7085 126.7947 90.2676 77.1158 153.4433 90.9731 97.9261 83.1746 149.7141 100.9339 97.407 103.1936 108.3046 99.0241 100.235 85.5688 97.2221 74.6021 150.3502 92.8178 94.9426 80.3077 149.0482 101.3638 100.9504 105.3827 107.9163 100.4571 103.5844 89.1947 94.8439 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|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 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 3 3 8 8 13 13 28 28 3 3 8 8 13 13 23 23 5 6 28 29 4 5 28 29 4 4 5 5 6 6 29 29 4 5 6 28 2 2 2 2 10 10 11 11 18 18 19 19 9 10 18 19 9 9 10 10 11 11 19 19 9 10 11 18 7 7 7 7 32 32 32 32 15 15 16 16 23 23 24 24 14 14 15 15 16 16 24 24 14 15 16 23 12 12 12 12 35 35 35 35 14 14 19 19 20 20 21 21 14 18 20 21 4 4 24 24 25 25 26 26 4 23 25 26 9 9 29 29 30 30 31 31 9 28 30 31 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 4 4 4 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 9 9 9 9 9 9 9 9 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 14 14 14 14 14 14 14 14 17 17 17 17 17 17 17 17 17 17 17 17 22 22 22 22 22 22 22 22 22 22 22 22 27 27 27 27 27 27 27 27 27 27 27 27 23 23 23 23 23 23 23 23 28 28 28 28 28 28 28 28 4 4 4 4 6 6 6 6 28 28 28 28 28 28 28 28 29 29 29 29 22 22 22 22 9 9 9 9 9 9 9 9 11 11 11 11 18 18 18 18 18 18 18 18 19 19 19 19 27 27 27 27 27 27 27 27 14 14 14 14 14 14 14 14 23 23 23 23 23 23 23 23 24 24 24 24 17 17 17 17 17 17 17 17 18 18 18 18 18 18 18 18 19 19 19 19 23 23 23 23 23 23 23 23 24 24 24 24 28 28 28 28 28 28 28 28 29 29 29 29 12 22 12 22 12 22 12 22 2 27 2 27 2 27 2 27 22 22 22 22 34 34 34 34 1 27 1 27 1 27 1 27 27 27 27 27 23 24 25 26 27 32 27 32 27 32 27 32 33 33 33 33 17 36 17 36 17 36 17 36 17 17 17 17 28 29 30 31 28 29 30 31 17 35 17 35 17 35 17 35 1 22 1 22 1 22 1 22 22 22 22 22 18 19 20 21 18 19 20 21 7 36 7 36 7 36 7 36 7 7 7 7 1 12 1 12 1 12 1 12 12 12 12 12 1 2 1 2 1 2 1 2 2 2 2 2 93.292 6.205 -127.5177 145.3954 -13.4184 -100.5054 -169.7615 103.1515 4.704 -87.0091 109.5813 17.8682 -142.687 125.5999 -87.0411 -178.7542 179.6669 70.7631 -74.8839 7.9609 17.5236 -87.0589 118.4291 172.375 73.9897 177.6564 178.8432 -77.4901 -26.1082 77.5585 -78.3788 25.2879 -114.7569 73.5684 178.8638 -28.9743 74.6942 31.6085 -77.1983 174.1685 166.3599 68.7282 75.8904 -21.7413 -88.8311 173.5372 -10.265 -107.8967 -79.0434 -170.2914 -34.8588 84.399 -175.5244 -44.3538 -86.552 44.6185 139.9909 -88.8385 20.733 151.9036 -100.1759 83.3205 175.4391 -23.6627 77.0033 43.8088 -74.2854 177.45 173.6662 140.4716 22.3774 -85.8872 177.5754 -76.4213 69.6017 175.605 -87.8113 18.192 -41.7936 64.2098 87.7161 -172.6039 179.4762 -80.8438 24.0129 123.6929 -76.2519 23.4281 -71.5348 67.5293 179.5486 -25.8121 89.5452 45.8846 -70.7518 -179.4299 -15.3464 -59.0069 -175.6434 75.6786 177.1862 46.0894 -20.1975 -151.2944 -121.206 107.6971 83.6083 -47.4886 62.5433 19.8187 177.3618 -70.5027 -86.7544 174.8578 75.3323 -23.0555 -17.6777 -116.0655 177.5131 79.1253 68.2615 26.1446 175.6234 -73.5357 -90.5511 168.8842 73.5011 -27.0636 -21.6567 -122.2214 177.3971 76.8324 58.6707 26.2946 174.846 -72.9314 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 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 Berny optimization. local minimum Step number 26 out of a maximum of 216 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00265 0.00389 0.00494 0.00559 0.00772 0.01016 0.01157 0.01223 0.01374 0.01485 0.01673 0.01785 0.01911 0.02301 0.02354 0.02520 0.02710 0.02918 0.03178 0.03442 0.03608 0.04130 0.04309 0.04675 0.04880 0.05212 0.06014 0.06253 0.06732 0.06873 0.07583 0.07654 0.07767 0.07949 0.08050 0.08439 0.08500 0.08775 0.08941 0.09151 0.09601 0.09715 0.10042 0.10372 0.10509 0.11044 0.11221 0.11270 0.11396 0.11726 0.12009 0.12071 0.12403 0.12599 0.12708 0.12857 0.13176 0.13254 0.13479 0.13568 0.13640 0.13919 0.14190 0.14605 0.14735 0.14833 0.15507 0.15559 0.15871 0.16224 0.16282 0.16475 0.16645 0.16942 0.17889 0.18419 0.18927 0.19694 0.20502 0.21729 0.23283 0.23352 0.23596 0.23675 0.23773 0.24491 0.24612 0.24776 0.24916 0.25117 0.25588 0.25628 0.25744 0.25975 0.27273 0.27930 0.28013 0.31472 0.36941 0.41218 0.49119 1.54268 -2.89044882e-07 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 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 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 3.99978 4.33040 4.22954 4.70970 4.89512 4.23987 3.98370 4.59353 4.53369 4.68280 4.70992 2.55400 5.01721 3.99714 4.37605 4.80427 4.34173 5.09540 2.55216 2.57867 5.01025 4.02075 4.05440 4.98192 4.38899 4.79889 2.55395 5.17221 4.55476 4.01223 4.03983 2.55788 4.97016 4.48739 4.05710 4.00389 4.97929 4.33157 4.08173 4.02842 1.83685 1.89997 1.77866 1.80428 1.70336 2.59486 1.42774 1.53663 2.55909 1.34305 1.80270 1.61424 1.63282 2.66784 1.89398 1.80336 1.80849 2.53438 1.31965 1.46101 2.12397 1.70710 1.60855 1.54152 1.31548 2.72710 1.77323 1.61483 1.81523 2.77260 1.83170 1.50946 1.88970 1.70985 1.65674 1.74287 1.62083 1.51492 1.42152 2.75144 1.89310 1.65696 1.82993 2.69310 1.74614 1.45751 1.91658 1.73214 1.76126 1.39459 2.64315 1.60321 1.69535 1.39753 2.81445 1.54752 1.76007 1.78966 1.90545 1.51007 1.75974 1.80630 1.75438 1.34790 2.67408 1.59586 1.71366 1.44266 2.62116 1.75513 1.70187 1.79388 1.89153 1.72957 1.68408 1.47958 1.71373 1.33654 2.70421 1.59757 1.54575 1.43768 2.69596 1.64992 1.78194 1.86204 1.88248 1.69702 1.75521 1.54325 1.65503 1.56311 0.06701 -2.10732 2.67977 -0.33697 -1.83307 -2.95420 1.83288 0.13996 -1.42626 1.95188 0.38565 -2.73641 1.98055 -1.59419 3.12277 3.13151 1.21710 -1.32620 0.12481 0.40108 -1.42981 2.14401 3.11132 1.31072 3.06394 3.13559 -1.39437 -0.42648 1.32674 -1.35772 0.39551 -1.95277 1.32390 -3.10969 -0.46039 1.31125 0.57311 -1.34434 3.03998 3.03193 1.32321 1.25959 -0.44913 -1.64478 2.92968 -0.92285 -2.63157 -1.19149 -2.79482 -0.50939 1.60185 -3.09559 -1.29644 -1.49725 0.30190 2.47834 -2.00570 0.31590 2.11505 -1.06159 1.23465 3.09035 -0.36629 1.50956 0.92239 -1.23347 -3.11545 -3.02697 2.66904 0.51319 -1.36880 3.09249 -1.35428 1.20140 3.03782 -1.54022 0.29620 -0.69867 1.13775 1.58777 -3.02413 -3.08683 -1.41556 0.47570 2.14697 -1.26436 0.40692 -1.29301 1.17352 3.13385 -0.45675 1.60611 0.80157 -1.23975 3.13078 -0.21050 -1.01505 -3.05637 1.31416 -3.08914 1.44337 -0.30477 -2.05546 -1.95429 2.57822 1.49251 -0.25817 1.14784 0.34383 -3.13000 -1.16378 -1.50834 3.05410 1.32250 -0.39824 -0.28851 -2.00926 3.09761 1.37686 1.18188 0.45880 3.07546 -1.27296 -1.63940 2.94970 1.26316 -0.43092 -0.51945 -2.21353 3.11775 1.42367 0.99255 0.41773 3.11376 -1.19619 -0.00001 -0.00001 0.00001 -0.00002 -0.00001 -0.00002 0.00000 0.00001 -0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00002 -0.00001 -0.00001 -0.00000 -0.00003 0.00000 0.00000 -0.00002 0.00001 -0.00000 0.00002 0.00001 0.00001 0.00000 0.00001 -0.00002 0.00000 -0.00002 -0.00001 -0.00000 -0.00001 0.00001 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00002 -0.00001 -0.00000 0.00001 -0.00000 -0.00000 -0.00000 0.00002 -0.00000 -0.00001 0.00001 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 -0.00001 -0.00003 0.00000 -0.00003 -0.00002 0.00002 0.00003 0.00003 -0.00002 0.00000 -0.00001 0.00000 0.00001 -0.00004 0.00001 -0.00001 0.00001 -0.00002 0.00001 -0.00000 0.00001 -0.00000 -0.00002 0.00001 0.00002 -0.00001 0.00001 -0.00006 0.00001 0.00001 0.00000 0.00001 -0.00001 0.00000 0.00000 -0.00002 0.00001 0.00000 -0.00000 0.00000 -0.00001 -0.00001 -0.00001 -0.00000 0.00001 0.00002 -0.00001 -0.00001 0.00002 0.00000 -0.00001 -0.00001 0.00000 0.00000 -0.00002 -0.00001 -0.00001 -0.00001 -0.00000 -0.00002 -0.00001 0.00003 -0.00001 -0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00000 -0.00002 0.00001 0.00001 -0.00002 -0.00001 -0.00002 -0.00001 -0.00003 -0.00002 -0.00003 -0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00001 -0.00001 0.00001 0.00001 -0.00001 -0.00002 -0.00001 -0.00000 -0.00001 -0.00001 -0.00001 -0.00001 0.00000 -0.00001 -0.00000 -0.00001 0.00000 -0.00001 0.00001 -0.00000 -0.00001 -0.00000 0.00001 0.00000 0.00002 -0.00001 0.00001 0.00001 0.00000 0.00002 -0.00002 -0.00001 -0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00002 0.00000 0.00000 0.00002 0.00001 -0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00001 -0.00001 -0.00003 0.00001 -0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00000 -0.00001 0.00000 -0.00000 0.00001 0.00001 0.00002 0.00001 -0.00000 -0.00001 0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00002 0.00001 -0.00000 0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00001 0.00001 0.00000 -0.00000 0.00002 0.00001 -0.00001 0.00000 -0.00000 0.00000 -0.00002 -0.00001 -0.00001 0.00000 0.00001 0.00000 -0.00001 -0.00001 -0.00001 0.00001 -0.00001 0.00001 -0.00002 -0.00000 -0.00000 0.00002 0.00002 -0.00001 -0.00001 -0.00000 0.00002 0.00002 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00000 -0.00000 -0.00002 -0.00001 0.00001 -0.00016 0.00032 0.00004 -0.00002 -0.00001 0.00003 -0.00010 0.00028 -0.00008 0.00034 -0.00003 0.00056 0.00008 0.00013 -0.00009 -0.00016 -0.00026 -0.00001 0.00001 -0.00023 0.00010 0.00001 0.00036 -0.00000 0.00009 0.00006 -0.00008 0.00009 0.00001 -0.00003 -0.00001 -0.00012 -0.00007 0.00011 -0.00000 -0.00012 0.00007 0.00004 -0.00002 -0.00001 -0.00018 -0.00010 0.00004 -0.00002 0.00024 0.00019 -0.00013 0.00011 0.00011 -0.00004 0.00003 0.00001 -0.00001 0.00005 0.00001 0.00005 -0.00008 -0.00001 -0.00006 0.00010 -0.00004 -0.00020 0.00001 -0.00009 0.00005 0.00013 -0.00029 0.00003 0.00001 0.00006 0.00008 0.00010 -0.00026 -0.00001 -0.00027 -0.00018 0.00003 -0.00001 0.00020 0.00005 -0.00029 -0.00010 0.00020 0.00008 0.00008 -0.00004 0.00002 0.00009 0.00008 0.00009 -0.00016 -0.00002 0.00003 -0.00018 0.00019 -0.00001 0.00007 -0.00003 -0.00002 0.00055 0.00039 -0.00005 -0.00001 0.00007 -0.00019 0.00006 0.00018 0.00007 0.00000 0.00004 0.00001 -0.00013 -0.00010 0.00006 -0.00007 -0.00002 -0.00004 -0.00021 0.00002 0.00027 -0.00001 -0.00012 0.00024 -0.00016 0.00011 -0.00005 -0.00009 0.00013 -0.00002 0.00001 -0.00008 0.00000 0.00033 0.00041 0.00014 0.00022 0.00000 0.00008 -0.00006 -0.00004 -0.00003 -0.00001 0.00020 0.00022 0.00003 0.00005 0.00000 -0.00006 0.00001 -0.00010 -0.00022 -0.00020 -0.00019 -0.00024 -0.00005 0.00007 -0.00009 0.00004 -0.00009 0.00003 -0.00005 0.00008 0.00002 -0.00008 -0.00003 -0.00007 -0.00004 -0.00045 -0.00020 -0.00005 0.00020 0.00028 0.00006 0.00014 -0.00004 0.00004 -0.00023 -0.00015 0.00062 0.00083 0.00025 0.00072 0.00005 0.00044 -0.00009 0.00030 0.00042 0.00081 -0.00004 0.00035 0.00026 -0.00022 -0.00004 0.00006 0.00001 -0.00054 0.00014 0.00019 -0.00025 -0.00080 -0.00012 -0.00007 0.00017 0.00026 0.00011 0.00020 -0.00010 -0.00001 -0.00034 -0.00024 -0.00002 0.00004 -0.00017 -0.00011 0.00015 0.00021 -0.00024 -0.00018 0.00046 -0.00006 -0.00001 0.00021 -0.00002 -0.00014 0.00013 0.00019 -0.00007 -0.00019 0.00008 0.00014 0.00003 -0.00052 0.00005 -0.00050 0.00002 -0.00053 0.00009 -0.00046 0.00007 -0.00006 -0.00024 -0.00025 0.00016 0.00027 0.00006 0.00017 -0.00034 -0.00023 0.00010 0.00021 0.00021 -0.00017 -0.00010 -0.00022 0.00014 0.00024 -0.00017 -0.00007 0.00025 0.00035 -0.00008 0.00002 0.00062 0.00010 -0.00005 -0.00013 0.00001 -0.00007 0.00005 -0.00022 -0.00003 -0.00013 0.00001 0.00012 -0.00006 0.00000 -0.00008 0.00004 -0.00002 0.00000 -0.00009 0.00001 0.00001 -0.00023 0.00002 0.00005 0.00004 -0.00003 -0.00003 0.00016 0.00007 0.00004 -0.00004 -0.00001 -0.00010 0.00002 -0.00002 -0.00003 -0.00005 -0.00008 -0.00002 0.00000 -0.00005 -0.00003 -0.00001 -0.00007 0.00003 -0.00003 -0.00009 -0.00000 0.00003 0.00003 -0.00003 0.00005 0.00003 -0.00001 0.00002 0.00004 -0.00004 -0.00006 -0.00001 -0.00005 0.00005 0.00006 0.00000 -0.00001 -0.00011 0.00008 -0.00015 -0.00010 0.00008 0.00013 0.00020 -0.00014 0.00001 -0.00008 0.00001 0.00002 -0.00001 0.00004 -0.00006 0.00014 -0.00011 0.00009 -0.00004 0.00002 -0.00004 -0.00015 0.00003 0.00017 0.00002 0.00001 -0.00017 -0.00007 -0.00001 -0.00002 0.00001 -0.00007 0.00001 0.00004 -0.00003 -0.00002 0.00005 -0.00001 0.00003 -0.00004 -0.00014 -0.00006 -0.00003 0.00001 0.00002 -0.00008 -0.00001 0.00008 0.00004 -0.00010 -0.00002 0.00005 0.00003 -0.00016 -0.00014 -0.00007 -0.00006 -0.00001 -0.00003 -0.00002 0.00015 -0.00001 -0.00006 0.00006 -0.00000 -0.00010 0.00003 0.00003 -0.00001 0.00001 -0.00001 -0.00014 -0.00004 -0.00027 -0.00017 -0.00012 -0.00001 -0.00013 -0.00002 -0.00012 -0.00013 -0.00010 -0.00011 -0.00009 -0.00011 -0.00003 -0.00004 0.00003 0.00002 -0.00004 -0.00012 -0.00003 -0.00006 -0.00003 -0.00012 -0.00002 -0.00003 -0.00002 -0.00003 -0.00005 -0.00006 0.00003 0.00002 0.00006 -0.00009 -0.00010 -0.00002 0.00014 -0.00014 0.00006 0.00004 0.00015 0.00021 -0.00004 0.00001 0.00005 0.00011 0.00002 0.00007 -0.00011 0.00007 0.00005 -0.00001 0.00012 0.00006 0.00001 -0.00006 -0.00003 -0.00010 0.00002 -0.00004 -0.00001 -0.00017 0.00005 -0.00003 -0.00004 -0.00009 0.00001 -0.00002 -0.00003 -0.00007 0.00003 0.00000 0.00007 -0.00001 0.00011 0.00002 -0.00006 -0.00015 -0.00019 -0.00027 0.00022 0.00008 0.00013 -0.00001 0.00029 0.00015 0.00017 0.00003 0.00010 -0.00018 -0.00021 -0.00003 -0.00015 -0.00020 -0.00017 -0.00019 -0.00003 -0.00007 -0.00004 -0.00006 -0.00002 0.00013 -0.00003 0.00012 -0.00029 -0.00014 -0.00004 0.00011 0.00006 0.00003 -0.00000 0.00004 -0.00012 0.00004 -0.00020 -0.00004 -0.00031 -0.00014 -0.00013 0.00004 0.00031 0.00004 0.00009 0.00013 0.00004 0.00000 0.00001 -0.00003 0.00005 0.00002 -0.00010 -0.00014 0.00006 0.00002 -0.00005 -0.00005 0.00002 -0.00023 0.00037 -0.00018 -0.00005 -0.00014 0.00004 0.00003 0.00021 -0.00008 0.00026 0.00001 0.00055 0.00008 0.00003 -0.00008 -0.00015 -0.00050 0.00000 0.00005 -0.00019 0.00008 -0.00002 0.00051 0.00007 0.00014 0.00002 -0.00009 -0.00000 0.00003 -0.00004 -0.00004 -0.00017 -0.00015 0.00008 0.00000 -0.00017 0.00004 0.00004 -0.00009 0.00002 -0.00021 -0.00019 0.00003 0.00001 0.00027 0.00015 -0.00008 0.00014 0.00011 -0.00002 0.00007 -0.00003 -0.00007 0.00005 -0.00004 0.00010 -0.00002 -0.00001 -0.00007 -0.00001 0.00004 -0.00035 -0.00009 -0.00002 0.00018 0.00033 -0.00042 0.00004 -0.00007 0.00007 0.00010 0.00009 -0.00022 -0.00007 -0.00013 -0.00029 0.00012 -0.00005 0.00022 0.00001 -0.00044 -0.00007 0.00037 0.00010 0.00009 -0.00020 -0.00005 0.00008 0.00006 0.00009 -0.00023 -0.00000 0.00007 -0.00021 0.00017 0.00004 0.00006 -0.00000 -0.00006 0.00041 0.00034 -0.00008 0.00000 0.00008 -0.00027 0.00005 0.00027 0.00011 -0.00009 0.00002 0.00006 -0.00010 -0.00027 -0.00008 -0.00014 -0.00008 -0.00005 -0.00023 0.00000 0.00042 -0.00001 -0.00019 0.00030 -0.00016 0.00001 -0.00002 -0.00006 0.00012 -0.00001 0.00000 -0.00022 -0.00003 0.00006 0.00024 0.00002 0.00020 -0.00013 0.00006 -0.00018 -0.00017 -0.00013 -0.00012 0.00011 0.00012 -0.00000 0.00001 0.00003 -0.00003 -0.00002 -0.00022 -0.00025 -0.00026 -0.00022 -0.00036 -0.00007 0.00004 -0.00011 0.00001 -0.00014 -0.00002 -0.00002 0.00010 0.00009 -0.00016 -0.00013 -0.00010 0.00010 -0.00059 -0.00014 -0.00000 0.00035 0.00049 0.00002 0.00015 0.00001 0.00014 -0.00021 -0.00008 0.00051 0.00089 0.00030 0.00071 0.00017 0.00050 -0.00008 0.00024 0.00039 0.00071 -0.00001 0.00031 0.00025 -0.00038 0.00001 0.00003 -0.00004 -0.00062 0.00015 0.00017 -0.00028 -0.00087 -0.00009 -0.00007 0.00024 0.00025 0.00022 0.00023 -0.00017 -0.00015 -0.00052 -0.00051 0.00019 0.00011 -0.00004 -0.00012 0.00044 0.00036 -0.00007 -0.00015 0.00056 -0.00024 -0.00022 0.00018 -0.00018 -0.00034 -0.00003 0.00000 -0.00010 -0.00026 0.00004 0.00008 0.00001 -0.00039 0.00003 -0.00038 -0.00027 -0.00067 0.00005 -0.00035 0.00013 -0.00003 -0.00024 -0.00021 0.00004 0.00032 -0.00014 0.00014 -0.00065 -0.00037 -0.00003 0.00025 0.00051 -0.00013 -0.00000 -0.00008 0.00018 0.00024 -0.00016 -0.00010 0.00030 0.00037 -0.00018 -0.00012 0.00069 0.00012 -0.00010 -0.00019 3.99980 4.33017 4.22992 4.70952 4.89507 4.23973 3.98374 4.59355 4.53390 4.68272 4.71018 2.55401 5.01776 3.99723 4.37608 4.80419 4.34158 5.09490 2.55216 2.57872 5.01006 4.02083 4.05438 4.98243 4.38906 4.79903 2.55397 5.17212 4.55475 4.01226 4.03979 2.55785 4.96999 4.48725 4.05718 4.00389 4.97912 4.33161 4.08177 4.02832 1.83687 1.89976 1.77848 1.80431 1.70337 2.59513 1.42789 1.53655 2.55923 1.34316 1.80268 1.61430 1.63278 2.66778 1.89403 1.80332 1.80859 2.53436 1.31964 1.46094 2.12396 1.70714 1.60819 1.54143 1.31546 2.72728 1.77356 1.61441 1.81527 2.77252 1.83176 1.50956 1.88979 1.70963 1.65667 1.74274 1.62054 1.51503 1.42147 2.75167 1.89311 1.65651 1.82985 2.69347 1.74623 1.45760 1.91637 1.73209 1.76134 1.39465 2.64325 1.60298 1.69535 1.39759 2.81424 1.54769 1.76011 1.78972 1.90545 1.51000 1.76015 1.80664 1.75430 1.34790 2.67416 1.59559 1.71370 1.44293 2.62127 1.75504 1.70189 1.79394 1.89144 1.72931 1.68400 1.47944 1.71365 1.33649 2.70398 1.59757 1.54617 1.43767 2.69578 1.65022 1.78178 1.86205 1.88245 1.69696 1.75533 1.54324 1.65503 1.56289 0.06697 -2.10726 2.68001 -0.33695 -1.83286 -2.95433 1.83294 0.13978 -1.42643 1.95175 0.38553 -2.73631 1.98066 -1.59419 3.12278 3.13154 1.21707 -1.32622 0.12459 0.40083 -1.43007 2.14380 3.11096 1.31064 3.06398 3.13548 -1.39436 -0.42662 1.32672 -1.35773 0.39561 -1.95269 1.32374 -3.10983 -0.46048 1.31135 0.57252 -1.34448 3.03998 3.03229 1.32370 1.25961 -0.44897 -1.64477 2.92982 -0.92306 -2.63165 -1.19098 -2.79393 -0.50908 1.60256 -3.09542 -1.29595 -1.49733 0.30214 2.47873 -2.00499 0.31589 2.11536 -1.06134 1.23426 3.09036 -0.36626 1.50952 0.92176 -1.23332 -3.11529 -3.02725 2.66817 0.51310 -1.36888 3.09273 -1.35403 1.20162 3.03805 -1.54038 0.29605 -0.69919 1.13723 1.58797 -3.02402 -3.08687 -1.41568 0.47614 2.14734 -1.26443 0.40677 -1.29245 1.17328 3.13363 -0.45657 1.60594 0.80123 -1.23979 3.13078 -0.21060 -1.01531 -3.05633 1.31424 -3.08912 1.44298 -0.30475 -2.05583 -1.95456 2.57754 1.49256 -0.25852 1.14797 0.34380 -3.13024 -1.16399 -1.50830 3.05441 1.32236 -0.39811 -0.28916 -2.00963 3.09758 1.37711 1.18239 0.45867 3.07546 -1.27305 -1.63923 2.94994 1.26300 -0.43101 -0.51915 -2.21317 3.11757 1.42355 0.99324 0.41785 3.11367 -1.19638 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000056 0.000012 0.001556 0.000308 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -1.353253e-07 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 1 1 1 1 1 2 2 2 2 2 4 6 7 7 7 7 7 9 9 11 12 12 12 12 12 14 14 17 17 17 17 18 22 22 22 22 27 27 27 27 3 8 13 23 28 4 5 6 28 29 22 34 9 10 11 18 19 27 32 33 14 15 16 23 24 17 35 18 19 20 21 36 23 24 25 26 28 29 30 31 2.1166 2.2915 2.2382 2.4923 2.5904 2.2436 2.1081 2.4308 2.3991 2.478 2.4924 1.3515 2.655 2.1152 2.3157 2.5423 2.2975 2.6964 1.3505 1.3646 2.6513 2.1277 2.1455 2.6363 2.3226 2.5395 1.3515 2.737 2.4103 2.1232 2.1378 1.3536 2.6301 2.3746 2.1469 2.1188 2.6349 2.2922 2.16 2.1317 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-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 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 3 3 3 3 8 8 8 13 13 23 4 4 4 4 5 5 5 6 6 28 2 2 9 9 9 9 10 10 10 11 11 18 7 7 27 7 14 14 14 14 15 15 15 16 16 23 12 12 17 14 14 14 14 18 18 18 19 19 20 7 7 17 7 4 4 4 4 23 23 23 24 24 25 1 1 12 12 9 9 9 9 28 28 28 29 29 30 1 1 2 2 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 4 6 7 7 7 7 7 7 7 7 7 7 9 9 9 11 12 12 12 12 12 12 12 12 12 12 14 14 14 17 17 17 17 17 17 17 17 17 17 18 18 18 19 22 22 22 22 22 22 22 22 22 22 23 23 23 24 27 27 27 27 27 27 27 27 27 27 28 28 28 29 8 13 23 28 13 23 28 23 28 28 5 6 28 29 6 28 29 28 29 29 22 34 10 11 18 19 11 18 19 18 19 19 27 32 32 33 15 16 23 24 16 23 24 23 24 24 17 35 35 18 19 20 21 19 20 21 20 21 21 17 36 36 17 23 24 25 26 24 25 26 25 26 26 12 22 22 22 28 29 30 31 29 30 31 30 31 31 2 27 27 27 105.2436 108.8604 101.9099 103.3776 97.5956 148.6747 81.8033 88.0425 146.6251 76.9509 103.2871 92.4889 93.5534 152.8561 108.5171 103.3249 103.6188 145.2091 75.6102 83.7097 121.6947 97.8097 92.1629 88.3224 75.3714 156.2514 101.5987 92.523 104.0049 158.8581 104.9484 86.4859 108.2718 97.9671 94.9243 99.8589 92.8667 86.7984 81.4468 157.646 108.4664 94.9366 104.8471 154.303 100.0462 83.5089 109.8118 99.2443 100.9128 79.9042 151.4416 91.8571 97.1366 80.0724 161.2563 88.6664 100.8449 102.5401 109.1743 86.5206 100.8254 103.4934 100.5185 77.229 153.2134 91.4358 98.1853 82.6582 150.1812 100.5617 97.51 102.7817 108.3768 99.0972 96.4907 84.7737 98.1898 76.5779 154.9398 91.5342 88.5648 82.373 154.4673 94.5333 102.0977 106.6871 107.8579 97.2322 100.5662 88.4217 94.826 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = -0.0001|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-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 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 3 3 8 8 13 13 28 28 3 3 8 8 13 13 23 23 5 6 28 29 4 5 28 29 4 4 5 5 6 6 29 29 4 5 6 28 2 2 2 2 10 10 11 11 18 18 19 19 9 10 18 19 9 9 10 10 11 11 19 19 9 10 11 18 7 7 7 7 32 32 32 32 15 15 16 16 23 23 24 24 14 14 15 15 16 16 24 24 14 15 16 23 12 12 12 12 35 35 35 35 14 14 19 19 20 20 21 21 14 18 20 21 4 4 24 24 25 25 26 26 4 23 25 26 9 9 29 29 30 30 31 31 9 28 30 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 4 4 4 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 9 9 9 9 9 9 9 9 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 14 14 14 14 14 14 14 14 17 17 17 17 17 17 17 17 17 17 17 17 22 22 22 22 22 22 22 22 22 22 22 22 27 27 27 27 27 27 27 27 27 27 27 23 23 23 23 23 23 23 23 28 28 28 28 28 28 28 28 4 4 4 4 6 6 6 6 28 28 28 28 28 28 28 28 29 29 29 29 22 22 22 22 9 9 9 9 9 9 9 9 11 11 11 11 18 18 18 18 18 18 18 18 19 19 19 19 27 27 27 27 27 27 27 27 14 14 14 14 14 14 14 14 23 23 23 23 23 23 23 23 24 24 24 24 17 17 17 17 17 17 17 17 18 18 18 18 18 18 18 18 19 19 19 19 23 23 23 23 23 23 23 23 24 24 24 24 28 28 28 28 28 28 28 28 29 29 29 12 22 12 22 12 22 12 22 2 27 2 27 2 27 2 27 22 22 22 22 34 34 34 34 1 27 1 27 1 27 1 27 27 27 27 27 23 24 25 26 27 32 27 32 27 32 27 32 33 33 33 33 17 36 17 36 17 36 17 36 17 17 17 17 28 29 30 31 28 29 30 31 17 35 17 35 17 35 17 35 1 22 1 22 1 22 1 22 22 22 22 22 18 19 20 21 18 19 20 21 7 36 7 36 7 36 7 36 7 7 7 7 1 12 1 12 1 12 1 12 12 12 12 12 1 2 1 2 1 2 1 2 2 2 2 89.5595 3.8393 -120.7404 153.5394 -19.3067 -105.0269 -169.2634 105.0164 8.0194 -81.7187 111.8344 22.0963 -156.785 113.4769 -91.3404 178.9215 179.4226 69.7347 -75.9856 7.1513 22.9802 -81.9218 122.843 178.2654 75.0985 175.5508 179.6561 -79.8916 -24.4355 76.0168 -77.7914 22.6608 -111.8857 75.8538 -178.1723 -26.3781 75.1292 32.8366 -77.025 174.178 173.7169 75.8143 72.1694 -25.7331 -94.239 167.8585 -52.8754 -150.7779 -68.2673 -160.1316 -29.1858 91.779 -177.3644 -74.2808 -85.7862 17.2974 141.9984 -114.918 18.0998 121.1834 -60.8249 70.74 177.0637 -20.987 86.4914 52.8489 -70.6724 -178.5024 -173.4328 152.9247 29.4034 -78.4266 177.1866 -77.5945 68.8354 174.0543 -88.2479 16.971 -40.0308 65.1881 90.9728 -173.27 -176.8625 -81.1053 27.2553 123.0125 -72.4426 23.3146 -74.0838 67.2378 179.5563 -26.1699 92.0235 45.9266 -71.0326 179.3802 -12.061 -58.1579 -175.1171 75.2957 -176.9945 82.6989 -17.4623 -117.7689 -111.9725 147.7209 85.5146 -14.792 65.7664 19.7003 -179.336 -66.6799 -86.4217 174.9869 75.7739 -22.8176 -16.5305 -115.122 177.4797 78.8883 67.7167 26.2874 176.211 -72.9355 -93.9309 169.0055 72.3739 -24.6896 -29.7626 -126.8261 178.6341 81.5705 56.8692 23.9342 178.4054 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-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 (5D, 7F) 32 33 34 35 36 S 3 1.00 1.3010701000e+01 1.9622572000e+00 4.4453796000e-01 1.9682158000e-02 1.3796524000e-01 4.7831935000e-01 S 1 1.00 1.2194962000e-01 1.0000000000e+00 P 1 1.00 8.0000000000e-01 1.0000000000e+00 3 4 5 6 8 9 10 11 13 14 15 16 18 19 20 21 23 24 25 26 28 29 30 31 S 5 1.00 9.1849303010e+03 1.3815105503e+03 3.1387147580e+02 8.8053870623e+01 2.7039914905e+01 -2.2294387756e-03 -1.6683029937e-02 -7.5262436116e-02 -1.9376827038e-01 -1.7718020803e-01 S 3 1.00 4.5648731303e+01 4.9664522326e+00 2.0116242047e+00 -1.0736062573e-01 6.5066293018e-01 5.9712155354e-01 S 1 1.00 3.5661077013e-01 1.0000000000e+00 S 1 1.00 1.3507221477e-01 1.0000000000e+00 P 5 1.00 2.6198233439e+02 6.1306894736e+01 1.9103729887e+01 6.6567720378e+00 2.3959635161e+00 -9.2729929822e-03 -6.6547669241e-02 -2.4828595903e-01 -4.8703847402e-01 -3.9337850312e-01 P 1 1.00 6.1776161679e-01 1.0000000000e+00 P 1 1.00 1.6993376871e-01 1.0000000000e+00 D 1 1.00 5.5000000000e-01 1.0000000000e+00 1 2 7 12 17 22 27 S 2 1.00 1.4000000000e+01 1.2500000000e+01 -2.2490043406e-01 3.3151248555e-01 S 1 1.00 4.0921501803e+00 1.0000000000e+00 S 1 1.00 9.7053602586e-01 1.0000000000e+00 S 1 1.00 4.4217620170e-01 1.0000000000e+00 S 1 1.00 9.2915024334e-02 1.0000000000e+00 S 1 1.00 3.5016314389e-02 1.0000000000e+00 P 4 1.00 8.8931117915e+00 5.4689112270e+00 1.3548473007e+00 6.5494867461e-01 6.9994449475e-02 -2.3547141883e-01 4.6315460007e-01 4.8820184710e-01 P 1 1.00 3.0428197472e-01 1.0000000000e+00 P 1 1.00 1.0000000000e-01 1.0000000000e+00 P 1 1.00 3.3000000000e-02 1.0000000000e+00 D 3 1.00 5.0044445497e+00 1.7736823324e+00 7.6950591696e-01 -2.1587364862e-02 2.0958680086e-01 4.3730880599e-01 D 1 1.00 3.1530878939e-01 1.0000000000e+00 D 1 1.00 1.1754374390e-01 1.0000000000e+00 F 1 1.00 1.1805100000e+00 1.0000000000e+00 F 1 1.00 3.3348000000e-01 1.0000000000e+00 G 1 1.00 6.4670000000e-01 1.0000000000e+00 1 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 2 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 3 16 No pseudopotential on this center. 4 16 No pseudopotential on this center. 5 16 No pseudopotential on this center. 6 16 No pseudopotential on this center. 7 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 8 16 No pseudopotential on this center. 9 16 No pseudopotential on this center. 10 16 No pseudopotential on this center. 11 16 No pseudopotential on this center. 12 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 13 16 No pseudopotential on this center. 14 16 No pseudopotential on this center. 15 16 No pseudopotential on this center. 16 16 No pseudopotential on this center. 17 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 18 16 No pseudopotential on this center. 19 16 No pseudopotential on this center. 20 16 No pseudopotential on this center. 21 16 No pseudopotential on this center. 22 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 23 16 No pseudopotential on this center. 24 16 No pseudopotential on this center. 25 16 No pseudopotential on this center. 26 16 No pseudopotential on this center. 27 42 14 F and up 2 2 9.4500000 4.7200000 -24.80517707 -4.15378155 0.00000000 0.00000000 S - F 2 2 2 2 9.7145938 4.6805004 9.4500000 4.7200000 180.10310850 24.99722791 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 P - F 2 2 2 2 8.1421366 4.6259863 9.4500000 4.7200000 123.77275231 19.53022800 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 D - F 2 2 2 2 6.6184148 3.2487516 9.4500000 4.7200000 48.37502229 8.89205274 24.80517707 4.15378155 0.00000000 0.00000000 0.00000000 0.00000000 28 16 No pseudopotential on this center. 29 16 No pseudopotential on this center. 30 16 No pseudopotential on this center. 31 16 No pseudopotential on this center. 32 1 No pseudopotential on this center. 33 1 No pseudopotential on this center. 34 1 No pseudopotential on this center. 35 1 No pseudopotential on this center. 36 1 No pseudopotential on this center. 0.10000e-02 0.10000e-05 F IExCor= 4134 DFT=T Ex+Corr=M06L ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi= 4 36 36 36 1.00e+00 60 F 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;2;27;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;s9;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:-.002,.063,-.815;2.782,2.468,.43;.473,1.803,-1.962;1.026,3.661,1.166;4.267,2.837,1.895;3.159,4.008,-1.424;.526,-3.601,.065;1.34,-1.549,-1.597;2.718,-2.663,1.376;.385,-5.262,1.388;2.192,-4.779,-1.279;-3.655,1.27,.116;-2.042,-.61,-1.467;-3.617,-.94,1.531;-4.52,2.39,1.716;-5.256,.39,-1.025;-2.719,-2.868,.089;-.45,-1.864,1.198;-1.208,-3.879,-1.444;-4.505,-2.879,-1.085;-2.92,-4.321,1.648;-1.172,3.774,-.027;-1.212,1.419,1.032;-2.892,2.881,-1.391;-.358,5.153,-1.473;-2.241,4.891,1.433;3.965,-.823,.042;1.862,.363,1.065;3.931,1.1,-1.256;4.788,-2.241,-1.35;5.427,-.461,1.551;3.512,-3.677,.97;2.602,-3.785,-2.095;2.444,5.053,-.953;-2.557,-.685,2.329;-.265,-1.547,2.456;/R:/0/N:7,17,27,1,12,2,22,11,18,10,20,21,9,30,31,3,8,13,15,16,6,5,25,26,19,14,29,24,4,28,23/E:(8,9)(11,12)(14,15)(16,17,18)(19,20)(23,24)/CRV:10.1,11.1,12.1,14.1,15.1,16.1,17.1,18.1,19.1,20.1,22.1,23.1,24.1,26.3,30.3,31.3 0.000000 3.883903 0.000000 2.137483 3.390482 0.000000 4.233999 2.246883 3.679994 0.000000 5.767455 2.118398 5.508179 3.422645 0.000000 5.091741 2.439476 3.516542 3.373158 3.689806 0.000000 3.805007 6.485023 5.771893 7.361986 7.667583 8.188204 0.000000 2.238533 4.724868 3.481497 5.905664 6.324428 5.849696 2.763249 0.000000 4.430571 5.217871 6.010609 6.549805 5.737487 7.248222 2.720924 3.461013 0.000000 5.775691 8.149618 7.819493 8.948748 8.995597 10.076474 2.128176 4.858870 3.492540 0.000000 5.336094 7.469122 6.836971 8.864039 8.507841 8.841238 2.443272 3.355582 3.435572 3.257519 0.000000 3.958285 6.555057 4.652156 5.360144 8.269124 7.503255 6.419502 5.985913 7.594157 7.785025 8.527827 0.000000 2.244913 6.028571 3.520344 5.881050 7.936519 6.955442 4.229389 3.512342 5.912280 5.973480 5.944969 2.939738 0.000000 4.424698 7.333067 6.037648 6.546745 8.749610 8.895443 5.137560 5.892972 6.566961 5.892040 7.508562 2.624456 3.402577 0.000000 5.677430 7.414788 6.229149 5.716297 8.800183 8.452489 8.004998 7.799442 8.833858 9.095038 10.267207 2.136030 5.027124 3.455218 0.000000 5.268353 8.428793 5.974611 7.413734 10.256790 9.168498 7.109691 6.898849 8.869627 8.341975 9.069497 2.153946 3.394873 3.314869 3.471999 0.000000 4.097568 7.671387 6.017782 7.603473 9.198525 9.171664 3.326844 4.588882 5.591007 4.129583 5.444379 4.242625 2.824540 2.569621 5.791139 4.276906 0.000000 2.822446 5.459109 4.927922 5.718848 6.695917 7.374290 2.292037 3.333969 3.272050 3.504244 4.648970 4.611367 3.348015 3.315804 5.910139 5.754987 2.717767 0.000000 4.170065 7.727638 5.948042 8.285798 9.285968 9.015312 2.315409 3.456098 4.984429 3.531368 3.520969 5.910466 3.373788 4.826140 7.762429 5.897985 2.378094 3.408072 0.000000 5.385654 9.164388 6.889901 8.856103 10.885818 10.309345 5.211021 6.016234 7.633800 5.975493 6.964011 4.402170 3.370557 3.375162 5.967260 3.354693 2.137333 4.762913 3.463970 0.000000 5.813824 8.949126 7.877051 8.917150 10.146474 10.759352 3.859949 6.030059 5.883026 3.446173 5.908438 5.843503 4.923985 3.454079 6.899431 5.898758 2.140582 3.512869 3.561850 3.472877 0.000000 3.970059 4.189105 3.214824 2.503442 5.844209 4.556745 7.568507 6.091746 7.650848 9.277703 9.275657 3.529271 4.695738 5.534183 4.020275 5.396899 6.820765 5.814547 7.783161 7.516027 8.449269 0.000000 2.591186 4.173109 3.456981 3.170672 5.724940 5.642739 5.399642 4.715227 5.676791 6.878438 7.439297 2.613332 3.324266 3.405570 3.514763 4.652314 4.640977 3.374358 5.848025 5.813634 6.020326 2.582461 0.000000 4.077377 5.973348 3.579295 4.743140 7.877247 6.155146 7.471210 6.130021 8.358488 9.207064 9.194303 2.334211 3.593794 4.864540 3.541880 3.453626 5.938967 5.931383 6.966797 5.989408 7.816976 2.369883 3.291014 0.000000 5.144687 4.548652 3.485998 3.332543 6.172350 3.699015 8.931932 6.914867 8.869523 10.826338 10.255962 5.335993 6.004004 7.534570 5.926730 6.846698 8.505916 7.508728 9.071955 9.047717 10.298600 2.157580 4.576800 3.404389 0.000000 5.777215 5.666345 5.331751 3.501068 6.840060 6.172693 9.035584 7.967312 9.036473 10.487197 10.977948 4.104330 6.221784 5.991956 3.395428 5.949033 7.889037 6.992348 9.287471 8.475784 9.239492 2.126511 3.643409 3.526879 3.472631 0.000000 4.154098 3.518624 4.806866 5.477897 4.113443 5.112470 4.420920 3.178682 2.592328 5.859423 4.531943 7.902564 6.197298 7.727712 9.226097 9.361447 6.989999 4.681051 6.189286 8.788525 7.887868 6.893906 5.727826 7.924112 7.529683 8.549802 0.000000 2.664375 2.383411 3.628450 3.403807 3.548746 4.600365 4.300952 3.318806 3.160084 5.824644 5.660689 5.671026 4.753837 5.651054 6.727738 7.418541 5.690123 3.212874 5.806423 7.461351 6.719172 4.693883 3.250492 5.913778 5.857811 6.121504 2.622162 0.000000 4.091252 2.456465 3.598668 4.567694 3.613705 3.013415 5.953022 3.721124 4.749628 7.748542 6.130847 7.710945 6.216538 8.300679 9.050762 9.217290 7.859806 5.831001 7.157870 9.328868 9.206338 5.890783 5.638010 7.052908 5.905033 7.726318 2.320321 3.195461 0.000000 5.342166 5.419144 5.945394 7.437507 6.048764 6.458260 4.692171 3.525419 3.448777 6.000791 3.631212 9.260698 7.023016 8.979799 10.839067 10.387960 7.669348 5.837044 6.216421 9.318644 8.528052 8.570423 7.420884 9.231412 9.009311 10.393140 2.150748 4.601578 3.450444 0.000000 5.945298 4.102646 6.481434 6.042178 3.512939 5.828071 6.007295 5.272307 3.495441 6.964046 6.092557 9.356191 8.057077 9.056698 10.348828 11.022090 8.619072 6.052450 8.042137 10.556507 9.196816 7.998257 6.919543 9.435576 8.609750 9.351794 2.132034 3.691124 3.543160 3.463022 0.000000 5.433417 6.211725 6.918276 7.750152 6.622526 8.056989 3.121057 3.979379 1.350358 3.530592 2.831043 8.750315 6.796497 7.656927 10.093465 9.869060 6.344762 4.363072 5.305337 8.314573 6.499619 8.857272 6.949046 9.465353 9.945554 10.330634 3.035080 4.364989 5.286811 3.012088 3.787802 0.000000 4.819369 6.745964 5.981310 8.280146 7.908426 7.841641 3.001538 2.615405 3.649682 4.384964 1.349812 8.342158 5.660543 7.740663 10.167459 8.962348 5.824413 4.883523 3.866360 7.235357 6.692520 8.698171 7.169822 8.666903 9.435906 10.543928 3.898459 5.266793 5.131607 2.778049 5.685325 3.199061 0.000000 5.558962 2.951128 3.932610 2.904918 4.042906 1.350959 8.922262 6.724578 8.064488 10.775852 9.840630 7.256146 7.242787 8.878177 7.919118 9.002153 9.512338 7.800444 9.662236 10.546215 11.108986 3.945728 5.523814 5.777744 2.851597 5.260082 6.150678 5.138789 4.234287 7.671661 6.750741 9.002858 8.912877 0.000000 4.119741 6.484792 5.812377 5.751363 7.691542 8.293486 4.809744 5.598802 5.713696 5.521755 7.234051 3.150396 3.831510 1.351084 3.699292 4.437290 3.131985 2.666205 5.124155 4.501526 3.716992 5.229880 2.813903 5.164008 7.305686 5.656363 6.912734 4.714187 7.624473 8.360933 8.024943 6.901573 7.469743 8.288918 0.000000 3.655230 5.432229 5.593377 5.518518 6.330340 7.591851 3.249843 4.359224 3.363056 3.919738 5.516602 4.990310 4.407451 3.529869 5.844022 6.385876 3.656480 1.310450 4.640848 5.682473 3.923897 5.941463 3.423703 6.427108 7.767605 6.811677 4.923868 3.179168 6.196125 6.363967 5.864920 4.583757 5.825799 7.906957 2.452027 0.000000 H5Mo7S24(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;2;27;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;s9;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.0014,-.066,-.8185;-2.788,-2.4636,.4288;-.4778,-1.8058,-1.9641;-1.0347,-3.66,1.1655;-4.2737,-2.828,1.8942;-3.1688,-4.0042,-1.4239;-.5181,3.5999,.0586;-1.337,1.5485,-1.6017;-2.7121,2.668,1.3706;-.3731,5.2617,1.3802;-2.1816,4.7807,-1.2862;3.6517,-1.2806,.113;2.0428,.6018,-1.4713;3.619,.9306,1.5262;4.5143,-2.4013,1.7138;5.2546,-.4052,-1.0289;2.7252,2.8595,.0828;.454,1.8616,1.1929;1.2163,3.8727,-1.4509;4.5111,2.8654,-1.0915;2.9297,4.3133,1.6406;1.1629,-3.779,-.0277;1.2085,-1.4233,1.0294;2.8848,-2.8911,-1.3926;.3456,-5.1573,-1.4724;2.2295,-4.8973,1.4331;-3.9635,.8298,.0382;-1.8631,-.3602,1.0619;-3.9341,-1.0943,-1.2582;-4.7834,2.2486,-1.3548;-5.4261,.4724,1.5477;-3.5038,3.6835,.9639;-2.5939,3.7869,-2.1013;-2.4561,-5.0505,-.9522;2.5585,.6787,2.3246;.2685,1.5461,2.4511;/R:/0/N:7,17,27,1,12,2,22,11,18,10,20,21,9,30,31,3,8,13,15,16,6,5,25,26,19,14,29,24,4,28,23/E:(8,9)(11,12)(14,15)(16,17,18)(19,20)(23,24)/CRV:10.1,11.1,12.1,14.1,15.1,16.1,17.1,18.1,19.1,20.1,22.1,23.1,24.1,26.3,30.3,31.3 0.0386632 0.0377004 0.0218380 -88.49401 -88.46398 -88.46221 -88.45357 -88.44642 -88.44581 -88.44570 -88.44157 -88.43823 -88.42991 -88.42952 -88.42944 -88.42824 -88.42628 -88.42379 -88.42272 -88.42073 -88.42019 -88.41861 -88.41663 -88.41550 -88.41323 -88.41305 -88.41222 -7.89001 -7.85958 -7.85619 -7.84910 -7.84159 -7.84121 -7.83982 -7.83573 -7.83428 -7.82590 -7.82386 -7.82331 -7.82257 -7.82245 -7.81994 -7.81874 -7.81651 -7.81488 -7.81376 -7.81264 -7.81140 -7.80953 -7.80899 -7.80725 -5.80284 -5.79821 -5.79611 -5.77044 -5.76872 -5.76837 -5.76754 -5.76529 -5.76215 -5.75973 -5.75855 -5.75635 -5.75380 -5.75264 -5.75231 -5.75042 -5.75006 -5.74874 -5.74852 -5.74788 -5.74598 -5.74537 -5.74491 -5.74481 -5.74478 -5.74345 -5.74192 -5.73620 -5.73516 -5.73399 -5.73376 -5.73364 -5.73307 -5.73249 -5.73247 -5.73239 -5.73210 -5.73165 -5.73165 -5.73130 -5.73102 -5.73084 -5.72985 -5.72974 -5.72895 -5.72813 -5.72763 -5.72657 -5.72650 -5.72620 -5.72491 -5.72440 -5.72396 -5.72396 -5.72393 -5.72306 -5.72277 -5.72268 -5.72203 -5.72171 -5.72071 -5.72046 -5.72027 -5.71969 -5.71934 -5.71887 -5.71879 -5.71816 -5.71661 -5.71618 -5.71607 -5.71265 -2.52932 -2.51480 -2.50460 -2.49607 -2.49580 -2.49563 -2.49267 -1.55260 -1.54965 -1.54689 -1.53732 -1.53600 -1.53419 -1.52814 -1.52399 -1.52332 -1.51946 -1.51842 -1.51752 -1.51672 -1.51656 -1.51562 -1.51548 -1.51518 -1.51488 -1.51421 -1.51273 -1.51230 -0.68785 -0.63933 -0.63202 -0.61772 -0.61154 -0.61041 -0.60137 -0.59460 -0.59074 -0.58938 -0.58324 -0.57964 -0.57910 -0.57690 -0.57528 -0.57182 -0.56893 -0.56764 -0.56614 -0.56381 -0.56116 -0.55706 -0.55608 -0.55570 -0.41389 -0.35048 -0.33965 -0.33355 -0.31645 -0.31231 -0.30062 -0.29579 -0.29246 -0.29114 -0.28511 -0.28283 -0.27902 -0.27749 -0.27603 -0.27007 -0.26880 -0.26624 -0.26333 -0.26171 -0.25899 -0.25789 -0.25561 -0.25333 -0.25014 -0.24815 -0.24586 -0.24521 -0.24275 -0.24079 -0.23909 -0.23753 -0.23534 -0.23314 -0.23235 -0.22839 -0.22755 -0.22651 -0.22494 -0.22369 -0.22166 -0.22077 -0.21815 -0.21755 -0.21235 -0.21087 -0.20922 -0.20571 -0.20266 -0.20167 -0.19833 -0.19588 -0.19127 -0.18986 -0.18680 -0.18464 -0.17953 -0.17615 -0.17376 -0.17086 -0.16848 -0.16496 -0.16402 -0.15675 -0.15403 -0.15213 -0.15145 -0.14920 -0.14711 -0.14617 -0.14029 -0.13488 -0.12339 -0.10633 -0.09559 -0.08787 -0.08494 -0.08253 -0.08001 -0.07648 -0.07469 -0.07276 -0.07096 -0.06729 -0.06452 -0.06076 -0.05705 -0.05493 -0.05128 -0.04927 -0.04168 -0.03885 -0.03724 -0.02430 -0.01841 -0.01399 -0.00835 -0.00774 0.00233 0.00500 0.01040 0.01718 0.01979 0.02109 0.02470 0.03199 0.04745 0.05692 0.07976 0.08486 0.09554 0.11106 0.11194 0.12166 0.12571 0.12684 0.13194 0.13364 0.13924 0.14286 0.14469 0.14953 0.15572 0.15693 0.16100 0.16751 0.16816 0.17173 0.17785 0.18001 0.18172 0.18466 0.18634 0.19023 0.19605 0.19972 0.20201 0.20365 0.21283 0.21420 0.22577 0.22875 0.23053 0.24011 0.24095 0.24994 0.25296 0.25675 0.25999 0.26417 0.26892 0.27228 0.27713 0.27840 0.28074 0.28401 0.28958 0.29359 0.29653 0.30144 0.30824 0.31066 0.31592 0.31739 0.32035 0.32175 0.32614 0.33140 0.33198 0.33753 0.34177 0.34586 0.34706 0.35114 0.35883 0.36064 0.36465 0.36926 0.37120 0.37596 0.38213 0.38583 0.38741 0.39369 0.39541 0.40233 0.40855 0.41171 0.41614 0.41778 0.42473 0.42840 0.43039 0.43486 0.43816 0.44857 0.45126 0.46267 0.46758 0.47617 0.48146 0.48414 0.49085 0.49468 0.50469 0.51022 0.51604 0.52190 0.52580 0.53019 0.53366 0.53841 0.54517 0.54738 0.55378 0.55539 0.55640 0.56108 0.56274 0.56439 0.56786 0.56973 0.57710 0.57934 0.58100 0.58610 0.58832 0.58889 0.59268 0.59306 0.59499 0.59899 0.60149 0.60391 0.60630 0.61165 0.61207 0.61356 0.61549 0.61761 0.62247 0.62521 0.62711 0.63075 0.63149 0.63297 0.63426 0.64072 0.64330 0.64570 0.64901 0.64980 0.65356 0.65474 0.65560 0.65703 0.66161 0.66460 0.66786 0.67305 0.67447 0.67484 0.67674 0.67830 0.67877 0.68513 0.68549 0.68616 0.68766 0.69065 0.69458 0.69610 0.69717 0.70311 0.70473 0.70746 0.70862 0.71408 0.71617 0.71890 0.72116 0.72278 0.72661 0.73330 0.73464 0.73861 0.73935 0.74305 0.75100 0.75467 0.75854 0.75975 0.76160 0.77522 0.77852 0.78124 0.78392 0.78858 0.79003 0.79721 0.80229 0.81012 0.81188 0.81641 0.82248 0.82956 0.83397 0.83907 0.84022 0.84238 0.85061 0.85320 0.85565 0.85818 0.85990 0.86191 0.86357 0.86712 0.87020 0.87283 0.87775 0.87968 0.88340 0.88657 0.89159 0.89440 0.89535 0.89804 0.89936 0.90177 0.90843 0.90916 0.91138 0.91193 0.91906 0.91991 0.92500 0.92663 0.93087 0.93533 0.93715 0.93961 0.94181 0.94484 0.94954 0.95079 0.95644 0.95933 0.96446 0.96717 0.97235 0.97270 0.97927 0.98018 0.98193 0.98449 0.98901 0.99405 1.00000 1.00225 1.00296 1.00948 1.01387 1.01957 1.02127 1.02584 1.03222 1.03722 1.04113 1.04353 1.04911 1.05316 1.05912 1.06544 1.06880 1.07389 1.07850 1.08043 1.08509 1.09245 1.09305 1.09796 1.10097 1.10618 1.11183 1.11304 1.11742 1.12214 1.12725 1.13149 1.13625 1.13904 1.14258 1.14552 1.14665 1.15387 1.15561 1.16031 1.16172 1.16381 1.16737 1.17237 1.17309 1.17901 1.18001 1.18298 1.18490 1.18833 1.19507 1.19716 1.19826 1.20120 1.20199 1.20703 1.21445 1.21665 1.21730 1.21916 1.22579 1.22639 1.22963 1.23128 1.23824 1.24605 1.24721 1.24918 1.25306 1.25839 1.26434 1.26657 1.26789 1.27384 1.27852 1.28257 1.28504 1.28878 1.29000 1.29648 1.30124 1.30468 1.31220 1.31476 1.32027 1.32338 1.33480 1.33657 1.34190 1.34431 1.35298 1.35983 1.36457 1.37108 1.37370 1.38241 1.38767 1.39665 1.40423 1.41236 1.42054 1.42269 1.43037 1.43493 1.44804 1.44837 1.45569 1.46145 1.46716 1.46984 1.47106 1.47771 1.49048 1.49201 1.49718 1.50163 1.50976 1.51502 1.52184 1.52350 1.53201 1.53598 1.53790 1.54637 1.54748 1.55576 1.56084 1.57279 1.58107 1.58805 1.59842 1.61086 1.61322 1.62207 1.62537 1.63263 1.64673 1.64839 1.65323 1.66043 1.67315 1.67677 1.67815 1.68808 1.69938 1.70345 1.70708 1.71890 1.73054 1.73941 1.74697 1.74917 1.76930 1.77735 1.78269 1.80024 1.80964 1.81409 1.82955 1.84604 1.85091 1.87416 1.87971 1.89397 1.91836 1.93885 1.94353 1.94909 1.95774 1.96918 1.98145 1.99123 1.99670 2.00042 2.00322 2.02061 2.02891 2.03473 2.05998 2.08443 2.09736 2.10911 2.13244 2.14639 2.17174 2.20746 2.23855 2.25102 2.32602 2.33901 2.34107 2.34592 2.36356 2.48539 2.49946 2.50765 2.50994 2.51198 2.51481 2.51614 2.51908 2.52006 2.52393 2.52665 2.52871 2.53440 2.53520 2.53897 2.54001 2.54265 2.54319 2.54542 2.54846 2.54897 2.55181 2.55670 2.55815 2.56332 2.56979 2.57165 2.57523 2.58081 2.58359 2.58676 2.59034 2.59318 2.59528 2.59659 2.60133 2.60266 2.60557 2.61169 2.61246 2.61490 2.61861 2.62125 2.62430 2.62716 2.62768 2.63211 2.63562 2.63725 2.64010 2.64346 2.64677 2.64908 2.65028 2.65688 2.66294 2.66411 2.66838 2.67209 2.67361 2.67937 2.68036 2.68626 2.68825 2.68963 2.69545 2.70008 2.70693 2.70995 2.71361 2.72614 2.72943 2.73230 2.74197 2.75034 2.75507 2.76230 2.76667 2.77177 2.77656 2.78207 2.81864 2.82225 2.82355 2.83312 2.83692 2.84106 2.84718 2.85519 2.86332 2.89033 2.89221 2.90509 2.91865 2.92301 2.92805 2.93230 2.94139 2.94376 2.95569 2.95917 2.96421 2.97656 2.98248 2.99510 3.10305 3.12826 3.13906 3.15156 3.15665 3.16185 3.17122 24.73578 24.75233 24.78524 24.82819 24.84025 24.86696 24.93372 84.93506 84.94470 84.95314 84.97131 84.97720 84.98150 84.99770 -88.49401 -88.46398 -88.46221 -88.45357 -88.44642 -88.44581 -88.44570 -88.44157 -88.43823 -88.42991 -88.42952 -88.42944 -88.42824 -88.42628 -88.42379 -88.42272 -88.42073 -88.42019 -88.41861 -88.41663 -88.41550 -88.41323 -88.41305 -88.41222 -7.89001 -7.85958 -7.85619 -7.84910 -7.84159 -7.84121 -7.83982 -7.83573 -7.83428 -7.82590 -7.82386 -7.82331 -7.82257 -7.82245 -7.81994 -7.81874 -7.81651 -7.81488 -7.81376 -7.81264 -7.81140 -7.80953 -7.80899 -7.80725 -5.80284 -5.79821 -5.79611 -5.77044 -5.76872 -5.76837 -5.76754 -5.76529 -5.76215 -5.75973 -5.75855 -5.75635 -5.75380 -5.75264 -5.75231 -5.75042 -5.75006 -5.74874 -5.74852 -5.74788 -5.74598 -5.74537 -5.74491 -5.74481 -5.74478 -5.74345 -5.74192 -5.73620 -5.73516 -5.73399 -5.73376 -5.73364 -5.73307 -5.73249 -5.73247 -5.73239 -5.73210 -5.73165 -5.73165 -5.73130 -5.73102 -5.73084 -5.72985 -5.72974 -5.72895 -5.72813 -5.72763 -5.72657 -5.72650 -5.72620 -5.72491 -5.72440 -5.72396 -5.72396 -5.72393 -5.72306 -5.72277 -5.72268 -5.72203 -5.72171 -5.72071 -5.72046 -5.72027 -5.71969 -5.71934 -5.71887 -5.71879 -5.71816 -5.71661 -5.71618 -5.71607 -5.71265 -2.52932 -2.51480 -2.50460 -2.49607 -2.49580 -2.49563 -2.49267 -1.55260 -1.54965 -1.54689 -1.53732 -1.53600 -1.53419 -1.52814 -1.52399 -1.52332 -1.51946 -1.51842 -1.51752 -1.51672 -1.51656 -1.51562 -1.51548 -1.51518 -1.51488 -1.51421 -1.51273 -1.51230 -0.68785 -0.63933 -0.63202 -0.61772 -0.61154 -0.61041 -0.60137 -0.59460 -0.59074 -0.58938 -0.58324 -0.57964 -0.57910 -0.57690 -0.57528 -0.57182 -0.56893 -0.56764 -0.56614 -0.56381 -0.56116 -0.55706 -0.55608 -0.55570 -0.41389 -0.35048 -0.33965 -0.33355 -0.31645 -0.31231 -0.30062 -0.29579 -0.29246 -0.29114 -0.28511 -0.28283 -0.27902 -0.27749 -0.27603 -0.27007 -0.26880 -0.26624 -0.26333 -0.26171 -0.25899 -0.25789 -0.25561 -0.25333 -0.25014 -0.24815 -0.24586 -0.24521 -0.24275 -0.24079 -0.23909 -0.23753 -0.23534 -0.23314 -0.23235 -0.22839 -0.22755 -0.22651 -0.22494 -0.22369 -0.22166 -0.22077 -0.21815 -0.21755 -0.21235 -0.21087 -0.20922 -0.20571 -0.20266 -0.20167 -0.19833 -0.19588 -0.19127 -0.18986 -0.18680 -0.18464 -0.17953 -0.17615 -0.17376 -0.17086 -0.16848 -0.16496 -0.16402 -0.15675 -0.15403 -0.15213 -0.15145 -0.14920 -0.14711 -0.14617 -0.14029 -0.13488 -0.12339 -0.10633 -0.09559 -0.08787 -0.08494 -0.08253 -0.08001 -0.07648 -0.07469 -0.07276 -0.07096 -0.06729 -0.06452 -0.06076 -0.05705 -0.05493 -0.05128 -0.04927 -0.04168 -0.03885 -0.03724 -0.02430 -0.01841 -0.01399 -0.00835 -0.00774 0.00233 0.00500 0.01040 0.01718 0.01979 0.02109 0.02470 0.03199 0.04745 0.05692 0.07976 0.08486 0.09554 0.11106 0.11194 0.12166 0.12571 0.12684 0.13194 0.13364 0.13924 0.14286 0.14469 0.14953 0.15572 0.15693 0.16100 0.16751 0.16816 0.17173 0.17785 0.18001 0.18172 0.18466 0.18634 0.19023 0.19605 0.19972 0.20201 0.20365 0.21283 0.21420 0.22577 0.22875 0.23053 0.24011 0.24095 0.24994 0.25296 0.25675 0.25999 0.26417 0.26892 0.27228 0.27713 0.27840 0.28074 0.28401 0.28958 0.29359 0.29653 0.30144 0.30824 0.31066 0.31592 0.31739 0.32035 0.32175 0.32614 0.33140 0.33198 0.33753 0.34177 0.34586 0.34706 0.35114 0.35883 0.36064 0.36465 0.36926 0.37120 0.37596 0.38213 0.38583 0.38741 0.39369 0.39541 0.40233 0.40855 0.41171 0.41614 0.41778 0.42473 0.42840 0.43039 0.43486 0.43816 0.44857 0.45126 0.46267 0.46758 0.47617 0.48146 0.48414 0.49085 0.49468 0.50469 0.51022 0.51604 0.52190 0.52580 0.53019 0.53366 0.53841 0.54517 0.54738 0.55378 0.55539 0.55640 0.56108 0.56274 0.56439 0.56786 0.56973 0.57710 0.57934 0.58100 0.58610 0.58832 0.58889 0.59268 0.59306 0.59499 0.59899 0.60149 0.60391 0.60630 0.61165 0.61207 0.61356 0.61549 0.61761 0.62247 0.62521 0.62711 0.63075 0.63149 0.63297 0.63426 0.64072 0.64330 0.64570 0.64901 0.64980 0.65356 0.65474 0.65560 0.65703 0.66161 0.66460 0.66786 0.67305 0.67447 0.67484 0.67674 0.67830 0.67877 0.68513 0.68549 0.68616 0.68766 0.69065 0.69458 0.69610 0.69717 0.70311 0.70473 0.70746 0.70862 0.71408 0.71617 0.71890 0.72116 0.72278 0.72661 0.73330 0.73464 0.73861 0.73935 0.74305 0.75100 0.75467 0.75854 0.75975 0.76160 0.77522 0.77852 0.78124 0.78392 0.78858 0.79003 0.79721 0.80229 0.81012 0.81188 0.81641 0.82248 0.82956 0.83397 0.83907 0.84022 0.84238 0.85061 0.85320 0.85565 0.85818 0.85990 0.86191 0.86357 0.86712 0.87020 0.87283 0.87775 0.87968 0.88340 0.88657 0.89159 0.89440 0.89535 0.89804 0.89936 0.90177 0.90843 0.90916 0.91138 0.91193 0.91906 0.91991 0.92500 0.92663 0.93087 0.93533 0.93715 0.93961 0.94181 0.94484 0.94954 0.95079 0.95644 0.95933 0.96446 0.96717 0.97235 0.97270 0.97927 0.98018 0.98193 0.98449 0.98901 0.99405 1.00000 1.00225 1.00296 1.00948 1.01387 1.01957 1.02127 1.02584 1.03222 1.03722 1.04113 1.04353 1.04911 1.05316 1.05912 1.06544 1.06880 1.07389 1.07850 1.08043 1.08509 1.09245 1.09305 1.09796 1.10097 1.10618 1.11183 1.11304 1.11742 1.12214 1.12725 1.13149 1.13625 1.13904 1.14258 1.14552 1.14665 1.15387 1.15561 1.16031 1.16172 1.16381 1.16737 1.17237 1.17309 1.17901 1.18001 1.18298 1.18490 1.18833 1.19507 1.19716 1.19826 1.20120 1.20199 1.20703 1.21445 1.21665 1.21730 1.21916 1.22579 1.22639 1.22963 1.23128 1.23824 1.24605 1.24721 1.24918 1.25306 1.25839 1.26434 1.26657 1.26789 1.27384 1.27852 1.28257 1.28504 1.28878 1.29000 1.29648 1.30124 1.30468 1.31220 1.31476 1.32027 1.32338 1.33480 1.33657 1.34190 1.34431 1.35298 1.35983 1.36457 1.37108 1.37370 1.38241 1.38767 1.39665 1.40423 1.41236 1.42054 1.42269 1.43037 1.43493 1.44804 1.44837 1.45569 1.46145 1.46716 1.46984 1.47106 1.47771 1.49048 1.49201 1.49718 1.50163 1.50976 1.51502 1.52184 1.52350 1.53201 1.53598 1.53790 1.54637 1.54748 1.55576 1.56084 1.57279 1.58107 1.58805 1.59842 1.61086 1.61322 1.62207 1.62537 1.63263 1.64673 1.64839 1.65323 1.66043 1.67315 1.67677 1.67815 1.68808 1.69938 1.70345 1.70708 1.71890 1.73054 1.73941 1.74697 1.74917 1.76930 1.77735 1.78269 1.80024 1.80964 1.81409 1.82955 1.84604 1.85091 1.87416 1.87971 1.89397 1.91836 1.93885 1.94353 1.94909 1.95774 1.96918 1.98145 1.99123 1.99670 2.00042 2.00322 2.02061 2.02891 2.03473 2.05998 2.08443 2.09736 2.10911 2.13244 2.14639 2.17174 2.20746 2.23855 2.25102 2.32602 2.33901 2.34107 2.34592 2.36356 2.48539 2.49946 2.50765 2.50994 2.51198 2.51481 2.51614 2.51908 2.52006 2.52393 2.52665 2.52871 2.53440 2.53520 2.53897 2.54001 2.54265 2.54319 2.54542 2.54846 2.54897 2.55181 2.55670 2.55815 2.56332 2.56979 2.57165 2.57523 2.58081 2.58359 2.58676 2.59034 2.59318 2.59528 2.59659 2.60133 2.60266 2.60557 2.61169 2.61246 2.61490 2.61861 2.62125 2.62430 2.62716 2.62768 2.63211 2.63562 2.63725 2.64010 2.64346 2.64677 2.64908 2.65028 2.65688 2.66294 2.66411 2.66838 2.67209 2.67361 2.67937 2.68036 2.68626 2.68825 2.68963 2.69545 2.70008 2.70693 2.70995 2.71361 2.72614 2.72943 2.73230 2.74197 2.75034 2.75507 2.76230 2.76667 2.77177 2.77656 2.78207 2.81864 2.82225 2.82355 2.83312 2.83692 2.84106 2.84718 2.85519 2.86332 2.89033 2.89221 2.90509 2.91865 2.92301 2.92805 2.93230 2.94139 2.94376 2.95569 2.95917 2.96421 2.97656 2.98248 2.99510 3.10305 3.12826 3.13906 3.15156 3.15665 3.16185 3.17122 24.73578 24.75233 24.78524 24.82819 24.84025 24.86696 24.93372 84.93506 84.94470 84.95314 84.97131 84.97720 84.98150 84.99770 1-A. 1.1325 4.7032 2.2162 5.3211 -564.0561 -534.8892 -490.0002 0.5828 -0.7933 0.9654 -34.4076 -5.2407 39.6483 0.5828 -0.7933 0.9654 52.6585 34.0021 10.3791 -24.7882 21.7135 -6.4646 17.4986 25.9663 1.5037 2.6796 -26790.1320 -25323.1538 -4632.5036 24.8700 -72.6654 84.3367 -57.7927 -6.3287 -38.6213 -8630.1322 -5097.0420 -4955.8943 2.4977 -140.6313 -21.0980 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.0121,.2614,-.7559;2.7669,2.5367,.3686;.4924,1.8434,-2.0775;1.0472,3.7534,1.1406;4.2876,2.8947,1.7839;3.1076,4.0242,-1.5235;.7026,-3.7887,-.0802;1.3386,-1.4905,-1.406;2.6461,-2.7271,1.3843;.329,-5.2918,1.3603;2.329,-4.7916,-1.3885;-3.6397,1.326,.1217;-1.9554,-.6163,-1.3627;-3.6474,-.903,1.5571;-4.5074,2.4678,1.6935;-5.2204,.4462,-1.0318;-2.7822,-2.834,.1529;-.4486,-2.0048,1.3182;-1.1888,-3.7862,-1.3845;-4.5418,-2.8489,-1.0352;-2.9373,-4.346,1.6563;-1.1378,3.8388,-.0554;-1.184,1.4626,1.0711;-2.8584,2.9006,-1.3964;-.3431,5.1893,-1.523;-2.2204,4.9674,1.3741;3.8307,-.7848,-.063;1.8151,.4572,1.0936;3.8772,1.1211,-1.3355;4.722,-2.2372,-1.3902;5.1763,-.4701,1.5602;3.5963,-3.6537,1.1345;2.8637,-3.6867,-1.9845;2.5261,5.1254,-.9984;-2.576,-.6585,2.3437;-.4697,-2.6064,2.5305;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3 0.000000 3.745747 0.000000 2.116593 3.411387 0.000000 4.106436 2.243642 3.783184 0.000000 5.627212 2.108084 5.515438 3.413510 0.000000 4.932544 2.430789 3.449951 3.378808 3.688846 0.000000 4.163707 6.668858 5.979422 7.648093 7.809953 8.301086 0.000000 2.291550 4.626808 3.504521 5.836851 6.172676 5.792625 2.728341 0.000000 4.522087 5.362272 6.124683 6.679310 5.870167 7.365339 2.654993 3.320294 0.000000 5.951156 8.259060 7.921841 9.076342 9.103211 10.140217 2.115198 4.808482 3.456433 0.000000 5.594739 7.548771 6.918911 9.003225 8.542848 8.851160 2.315704 3.446566 3.471525 3.436008 0.000000 3.903752 6.524646 4.709330 5.375603 8.250241 7.450653 6.712475 5.920315 7.585052 7.815403 8.679409 0.000000 2.238178 5.936217 3.542910 5.863146 7.823278 6.869734 4.332898 3.408301 5.759778 5.873127 5.982493 2.968667 0.000000 4.483071 7.374806 6.155554 6.625355 8.799962 8.910540 5.470909 5.829699 6.554753 5.925502 7.714619 2.651310 3.386831 0.000000 5.594076 7.394282 6.293464 5.728151 8.805871 8.411858 8.332729 7.710411 8.846157 9.149471 10.437166 2.127688 5.036333 3.481487 0.000000 5.243017 8.374240 5.973362 7.412103 10.214011 9.077369 7.343178 6.849196 8.819788 8.333229 9.195428 2.145495 3.449458 3.316204 3.467288 0.000000 4.267964 7.725527 6.129886 7.683369 9.244516 9.194286 3.620771 4.606139 5.567226 4.144654 5.686207 4.247626 2.810545 2.539466 5.784341 4.255371 0.000000 3.106355 5.645006 5.217675 5.951959 6.830339 7.554455 2.542308 3.298414 3.178517 3.377991 4.775745 4.765417 3.374244 3.391661 6.051339 5.856607 2.737016 0.000000 4.268473 7.661584 5.915924 8.259646 9.201337 8.915138 2.297543 3.414454 4.847117 3.479215 3.658687 5.866030 3.261329 4.796924 7.720058 5.855875 2.410273 3.320542 0.000000 5.521751 9.186534 6.960366 8.919732 10.903911 10.295183 5.412851 6.046656 7.585117 5.952359 7.148904 4.425203 3.432417 3.362475 5.976124 3.364298 2.123178 4.796364 3.499000 0.000000 5.978705 9.031436 8.000705 9.041131 10.229502 10.803269 4.071218 5.984501 5.819637 3.413297 6.099406 5.917800 4.897860 3.516807 6.992442 5.950093 2.137786 3.433515 3.552050 3.472687 0.000000 3.822402 4.137864 3.275341 2.492384 5.806053 4.495907 7.846411 6.029723 7.713694 9.355352 9.395734 3.550267 4.714320 5.602052 4.036362 5.397213 6.875553 6.042241 7.740068 7.567820 8.553230 0.000000 2.492268 4.154170 3.587291 3.198634 5.700753 5.631317 5.697442 4.606504 5.685157 6.927773 7.583265 2.636320 3.292380 3.449712 3.527412 4.663363 4.675208 3.553076 5.794746 5.856572 6.095517 2.630095 0.000000 3.951706 5.906947 3.579040 4.734719 7.821840 6.072220 7.691608 6.074316 8.348856 9.212766 9.277972 2.322554 3.631167 4.879940 3.528998 3.425772 5.940743 6.102412 6.892107 6.001798 7.863749 2.374625 3.310597 0.000000 4.999889 4.504033 3.492925 3.330079 6.135541 3.642071 9.153103 6.889197 8.947434 10.891178 10.333292 5.338252 6.027403 7.584322 5.923982 6.820976 8.551670 7.735487 9.016257 9.081822 10.380678 2.146926 4.617870 3.403054 0.000000 5.627363 5.638424 5.388108 3.493545 6.842383 6.137826 9.344932 7.880283 9.104217 10.571154 11.116061 4.103921 6.223940 6.044132 3.402987 5.935405 7.916323 7.193949 9.235714 8.502217 9.345143 2.118768 3.667344 3.514859 3.459284 0.000000 4.019469 3.514315 4.702121 5.458233 4.142291 5.077643 4.336858 2.917520 2.696367 5.882184 4.479588 7.765058 5.932629 7.652467 9.120743 9.185627 6.926475 4.659169 5.995816 8.677772 7.838523 6.787002 5.611059 7.752725 7.432483 8.471579 0.000000 2.590386 2.399124 3.705016 3.384814 3.539924 4.609022 4.543535 3.204478 3.303768 5.943969 5.828875 5.608440 4.626317 5.648399 6.661568 7.349559 5.731729 3.352053 5.759464 7.474809 6.780300 4.634108 3.163255 5.832046 5.822114 6.058470 2.634926 0.000000 4.001792 2.478033 3.539713 4.590156 3.611747 3.009228 5.979979 3.642800 4.870511 7.809129 6.112329 7.659598 6.085938 8.311712 9.016106 9.127675 7.887120 5.960352 7.053269 9.312965 9.234553 5.845931 5.614665 6.967038 5.864834 7.701696 2.292171 3.254792 0.000000 5.369180 5.450306 5.917166 7.469739 6.049784 6.467496 4.503175 3.464819 3.499667 6.016182 3.500244 9.214124 6.871335 8.972932 10.808679 10.304368 7.684443 5.841600 6.110394 9.290742 8.508364 8.546111 7.391013 9.157507 8.990263 10.379934 2.159958 4.677528 3.463338 0.000000 5.706861 4.033142 6.365862 5.921514 3.487374 5.829896 5.806688 4.956498 3.395114 6.839903 5.956274 9.111375 7.708787 8.834309 10.120428 10.754021 8.420573 5.835483 7.757701 10.336124 8.992270 7.813116 6.665460 9.201110 8.485206 9.182128 2.131747 3.517827 3.550289 3.468972 0.000000 5.634522 6.292544 7.083018 7.833532 6.616768 8.139665 3.141168 4.028709 1.350544 3.661848 3.044048 8.842122 6.803150 7.759876 10.171282 9.961717 6.505414 4.371911 5.409246 8.460673 6.590774 8.942310 7.002270 9.540880 10.038908 10.402587 3.117619 4.480422 5.383207 3.106140 3.579525 0.000000 5.022726 6.654082 6.017722 8.271712 7.716404 7.728453 2.882124 2.735629 3.509573 4.493183 1.364571 8.476846 5.747785 7.917425 10.282871 9.129099 6.096855 4.970653 4.097851 7.512911 6.880450 8.738719 7.227362 8.745332 9.448734 10.583932 3.612213 5.267468 4.956137 2.430542 5.315922 3.204030 0.000000 5.480721 2.937375 4.009057 2.940273 3.977522 1.351520 9.144952 6.733990 8.206950 10.904552 9.926703 7.328518 7.292727 8.999211 7.986224 9.050114 9.636222 8.065689 9.662629 10.655845 11.251823 3.996158 5.609338 5.839657 2.917487 5.308769 6.124373 5.164720 4.239534 7.693067 6.699274 9.097708 8.873518 0.000000 4.141446 6.531167 5.934688 5.834316 7.749016 8.317752 5.140329 5.484157 5.698159 5.556379 7.420979 3.163418 3.758231 1.351490 3.731862 4.428000 3.094332 2.718436 5.060273 4.480980 3.768394 5.296126 2.838267 5.170625 7.357513 5.719825 6.844904 4.699888 7.638506 8.348314 7.794008 6.966349 7.582384 8.405613 0.000000 4.388266 6.449912 6.477644 6.684361 7.311095 8.555528 3.096470 4.473375 3.322084 3.036162 5.288325 5.596049 4.617905 3.734545 6.538462 6.676648 3.324500 1.353574 4.151675 5.417987 3.143097 6.976668 4.381437 7.173182 8.787493 7.859034 5.342053 4.083021 6.909145 6.516293 6.114121 4.424674 5.715186 9.011661 2.875027 0.000000 H5Mo7S24(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.2332,-.0673,-.7421;2.019,-3.138,.4462;1.7221,-.8237,-2.0425;3.4974,-1.6281,1.2001;2.1145,-4.6719,1.8891;3.4407,-3.7513,-1.4277;-3.879,-.0718,-.0889;-1.7091,-1.0995,-1.3849;-3.159,-2.1372,1.416;-5.3082,.5685,1.3328;-5.1281,-1.5342,-1.3787;1.8783,3.3751,.0844;-.3061,2.0066,-1.3883;-.3271,3.7736,1.501;3.1384,4.071,1.6513;1.2764,5.0583,-1.102;-2.3662,3.2126,.0952;-1.9379,.7953,1.3053;-3.5586,1.7704,-1.4239;-2.0854,4.9297,-1.1216;-3.8404,3.64,1.5832;3.947,.492,-.0308;1.6044,.9473,1.075;3.3116,2.3195,-1.4075;5.1567,-.5391,-1.4739;5.2301,1.3995,1.3901;-1.4297,-3.6497,.0045;.1201,-1.8454,1.1383;.4497,-4.0306,-1.2512;-3.0014,-4.3136,-1.32;-1.3493,-5.0001,1.652;-4.2277,-2.9267,1.1741;-4.1227,-2.2533,-1.9566;4.6196,-3.3493,-.903;-.2662,2.6905,2.307;-2.5346,.9361,2.512;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3 0.0383304 0.0377107 0.0217225 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 947 947 947 947 947 MxSgAt= 36 MxSgA2= 36. 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 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 947 947 947 947 947 MxSgAt= 36 MxSgA2= 36. 1 -0.0000 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 Mo Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S H H H H H 95 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 1 1 1 1 1 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 1 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 2 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 3 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 4 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 5 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 6 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 7 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 8 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 9 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 10 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 11 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 12 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 13 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 14 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 15 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 16 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 17 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 18 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 19 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 20 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 21 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 22 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 23 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 24 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 25 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 26 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 27 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 28 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 29 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 30 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 31 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 32 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 33 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 34 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 35 H 1 4.45568134e-01 1.85038602e+00 8.71912634e-01 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 42 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 1 1 1 1 1 0.005014756 0.019917845 -0.003446442 0.003558304 0.006721792 0.001960305 -0.001559964 -0.007197031 0.001594043 0.000656864 -0.001132840 -0.000426825 -0.002969817 -0.001100234 -0.002961472 -0.001041022 -0.002133301 0.000884802 0.029033145 -0.039643093 -0.023879980 -0.002094571 -0.003945586 0.003075231 -0.002034634 -0.001214712 0.000624753 -0.001238875 0.007111773 -0.001976402 -0.004666308 0.002689939 0.006299051 -0.001953316 0.004629113 -0.001008970 0.000424209 -0.003603084 0.002588354 -0.000242429 -0.001165128 -0.000270749 0.001623162 -0.001699670 -0.002082461 0.001299627 -0.000875042 0.001307065 -0.020456198 0.001990763 -0.005218722 -0.015899402 0.021553967 -0.014008387 0.003967245 0.005114900 0.005252291 0.006090226 -0.000799433 0.004904208 0.001815002 0.000462737 0.000324026 0.000021322 0.006448431 -0.000169109 0.000567268 -0.004864486 0.001403103 -0.000863853 -0.001907585 0.001283316 -0.000761022 -0.002792160 0.002540417 0.001473496 -0.002095098 -0.002565284 0.004299207 0.004283097 -0.001564239 -0.003007793 -0.003666790 0.000954117 -0.000181601 -0.002174132 0.000435712 -0.001630559 0.000220386 0.001545288 -0.003151486 -0.000892886 -0.002231922 -0.000428995 -0.000574467 0.001115985 -0.000019956 0.000944672 -0.000641082 0.000185209 0.000398382 0.000199488 -0.002403917 0.001095201 0.000263518 0.006576676 -0.000106242 0.023896975 0.039643093 0.007514580 (Enter /apps/gaussian/g16c02/g16/l716.exe) -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 open 1 1 1 -10036.0362816950 -10036.0362843273 -0.000002632267 -10036.0362731749 0.000011152330 -10036.0362840519 -0.000010876909 -10036.0362845486 -0.000000496748 -10036.0362847145 -0.000000165943 -10036.0362847524 -0.000000037835 -10036.0362847576 -0.000000005228 -10036.0362847595 -0.000000001881 -10036.0362847594 0.000000000116 -10036.0362847597 -0.000000000276 -10036.0362847595 0.000000000196 -10036.0362848 12 -0.0000 9.701680631682e+03 -4.823281424453e+04 1.624954488378e+04 Using DIIS extrapolation, IDIIS= 1040. NGot= 14763950080 LenX= 14761999925 LenY= 14761042463 Requested convergence on RMS density matrix=1.00D-08 within 350 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. -0.0000 (Enter /apps/gaussian/g16c02/g16/l716.exe) 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 Mo Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S H H H H H 95 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 1 1 1 1 1 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 1 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 2 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 3 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 4 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 5 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 6 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 7 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 8 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 9 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 10 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 11 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 12 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 13 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 14 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 15 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 16 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 17 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 18 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 19 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 20 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 21 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 22 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 23 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 24 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 25 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 26 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 27 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 28 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 29 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 30 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 31 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 32 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 33 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 34 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 35 H 1 PT165616.600S 2025-07-25T12:23:56.000 -88.46225 -88.46078 -88.45940 -88.45578 -88.44465 -88.44393 -88.44309 -88.43826 -88.43364 -88.43009 -88.42933 -88.42867 -88.42823 -88.42483 -88.42449 -88.42178 -88.42113 -88.41949 -88.41687 -88.41600 -88.41504 -88.41468 -88.41429 -88.41100 -7.85715 -7.85543 -7.85535 -7.85003 -7.84013 -7.83916 -7.83662 -7.83435 -7.82982 -7.82625 -7.82515 -7.82299 -7.82260 -7.82116 -7.81884 -7.81737 -7.81592 -7.81504 -7.81297 -7.81237 -7.81121 -7.81077 -7.80937 -7.80743 -5.76879 -5.76824 -5.76620 -5.76581 -5.76409 -5.76400 -5.76393 -5.76328 -5.76246 -5.76186 -5.75896 -5.75619 -5.75028 -5.74983 -5.74927 -5.74899 -5.74845 -5.74778 -5.74746 -5.74585 -5.74552 -5.74302 -5.74273 -5.74167 -5.74048 -5.73903 -5.73736 -5.73647 -5.73541 -5.73493 -5.73429 -5.73413 -5.73359 -5.73338 -5.73280 -5.73217 -5.73192 -5.73107 -5.73106 -5.73096 -5.73068 -5.72920 -5.72881 -5.72789 -5.72745 -5.72702 -5.72690 -5.72600 -5.72554 -5.72536 -5.72512 -5.72432 -5.72408 -5.72339 -5.72333 -5.72253 -5.72244 -5.72231 -5.72218 -5.72188 -5.72101 -5.72047 -5.72040 -5.72031 -5.71969 -5.71828 -5.71824 -5.71819 -5.71803 -5.71657 -5.71477 -5.71474 -2.52510 -2.51023 -2.50350 -2.49721 -2.49632 -2.49415 -2.49188 -1.54741 -1.54519 -1.54270 -1.53214 -1.53148 -1.52955 -1.52772 -1.52291 -1.52212 -1.52115 -1.51934 -1.51769 -1.51650 -1.51644 -1.51621 -1.51505 -1.51442 -1.51400 -1.51386 -1.51226 -1.51144 -0.65251 -0.63881 -0.62997 -0.61881 -0.61152 -0.60545 -0.59830 -0.59509 -0.59132 -0.58619 -0.58473 -0.58025 -0.57578 -0.57496 -0.57409 -0.57271 -0.56978 -0.56929 -0.56723 -0.56368 -0.56094 -0.55746 -0.55607 -0.55537 -0.36323 -0.34499 -0.34185 -0.33327 -0.31430 -0.29674 -0.29470 -0.29411 -0.29148 -0.28494 -0.28250 -0.27999 -0.27586 -0.27480 -0.27153 -0.27021 -0.26816 -0.26501 -0.26179 -0.26084 -0.25844 -0.25619 -0.25483 -0.25257 -0.25099 -0.24766 -0.24544 -0.24385 -0.24316 -0.23978 -0.23912 -0.23581 -0.23524 -0.23292 -0.23189 -0.22963 -0.22746 -0.22565 -0.22357 -0.22258 -0.22140 -0.21874 -0.21849 -0.21672 -0.21150 -0.20902 -0.20767 -0.20628 -0.20298 -0.20213 -0.19642 -0.19535 -0.19165 -0.19039 -0.18498 -0.18271 -0.18085 -0.17722 -0.17588 -0.17154 -0.16777 -0.16566 -0.16193 -0.15620 -0.15290 -0.15219 -0.15136 -0.14894 -0.14625 -0.14432 -0.14110 -0.13319 -0.10926 -0.10144 -0.09160 -0.08848 -0.08554 -0.08150 -0.07522 -0.07393 -0.07155 -0.07022 -0.06740 -0.06215 -0.06003 -0.05781 -0.05574 -0.05374 -0.05237 -0.04818 -0.04377 -0.04011 -0.03752 -0.03190 -0.01685 -0.01236 -0.00938 -0.00047 0.00225 0.00943 0.01706 0.01957 0.02121 0.02229 0.02527 0.03424 0.04638 0.07728 0.08172 0.08652 0.09259 0.10792 0.11411 0.12244 0.12624 0.13097 0.13264 0.13418 0.14162 0.14291 0.14843 0.15080 0.15675 0.15906 0.16077 0.16691 0.16798 0.17182 0.17638 0.17892 0.18185 0.18548 0.18854 0.19153 0.19543 0.19962 0.20255 0.20496 0.21496 0.21693 0.22257 0.23116 0.23426 0.24388 0.24764 0.25051 0.25277 0.26000 0.26114 0.26986 0.27107 0.27441 0.27989 0.28205 0.28591 0.28840 0.29196 0.29413 0.29819 0.30405 0.30643 0.30900 0.31680 0.32057 0.32423 0.32515 0.32902 0.33111 0.33521 0.34169 0.34285 0.34762 0.35018 0.35643 0.36114 0.36442 0.36537 0.36957 0.37436 0.38083 0.38250 0.38761 0.39236 0.39371 0.40013 0.40164 0.40786 0.41073 0.41521 0.42002 0.42516 0.42973 0.43285 0.43673 0.44261 0.44600 0.45235 0.46696 0.46818 0.47142 0.47900 0.48334 0.49276 0.49577 0.50771 0.51183 0.51373 0.52198 0.52367 0.53453 0.53715 0.53778 0.54423 0.55021 0.55079 0.55305 0.55619 0.56148 0.56177 0.56483 0.56932 0.57039 0.57722 0.57816 0.58278 0.58788 0.58936 0.59015 0.59272 0.59562 0.59821 0.60117 0.60423 0.60666 0.61105 0.61329 0.61362 0.61494 0.61550 0.62031 0.62256 0.62524 0.62677 0.62958 0.63220 0.63558 0.63897 0.64122 0.64440 0.64618 0.64866 0.65228 0.65322 0.65415 0.65865 0.65976 0.66224 0.66399 0.66527 0.66997 0.67035 0.67388 0.67671 0.67996 0.68033 0.68111 0.68467 0.68895 0.69019 0.69152 0.69400 0.69548 0.69938 0.70128 0.70472 0.70807 0.70972 0.71120 0.71601 0.71777 0.72078 0.72395 0.73144 0.73423 0.73562 0.73664 0.74324 0.74954 0.75137 0.75262 0.75811 0.76359 0.76897 0.77042 0.77571 0.77838 0.78664 0.78782 0.79429 0.80079 0.80488 0.81242 0.81416 0.81737 0.82677 0.82891 0.83386 0.83872 0.84290 0.84640 0.85001 0.85253 0.85381 0.85540 0.85741 0.86352 0.86591 0.86884 0.86983 0.87586 0.87777 0.87959 0.88468 0.88508 0.88764 0.89263 0.89517 0.89701 0.89841 0.89945 0.90575 0.91065 0.91360 0.91667 0.91985 0.92062 0.92792 0.93056 0.93410 0.93486 0.93657 0.93754 0.94152 0.94271 0.94770 0.95121 0.95319 0.96321 0.96577 0.97053 0.97411 0.97556 0.97985 0.98288 0.98711 0.99040 0.99249 0.99466 0.99779 1.00437 1.00647 1.01043 1.01319 1.01784 1.02092 1.02753 1.03410 1.03963 1.04414 1.04796 1.05085 1.05733 1.06004 1.06794 1.07085 1.07444 1.08187 1.08274 1.08891 1.09114 1.09516 1.10008 1.10589 1.10727 1.10820 1.11476 1.11778 1.12467 1.12589 1.12981 1.13294 1.13888 1.14390 1.14545 1.15080 1.15614 1.15822 1.15984 1.16184 1.16553 1.16654 1.16965 1.17454 1.17532 1.18203 1.18421 1.18764 1.19221 1.19532 1.19951 1.20123 1.20342 1.20607 1.20963 1.21171 1.21274 1.21885 1.22035 1.22796 1.22971 1.23272 1.23658 1.23852 1.24420 1.24658 1.24969 1.25166 1.26179 1.26368 1.26901 1.27108 1.27844 1.27945 1.28114 1.28630 1.28954 1.29792 1.29852 1.30663 1.30869 1.31477 1.32019 1.32256 1.32769 1.34036 1.34383 1.34704 1.35068 1.35273 1.35800 1.36647 1.37642 1.38034 1.38538 1.39057 1.39207 1.40154 1.40830 1.41634 1.42503 1.42992 1.43619 1.44319 1.44456 1.44953 1.45936 1.46225 1.46565 1.47076 1.47431 1.48479 1.49144 1.49635 1.50275 1.50667 1.51319 1.51790 1.52323 1.53187 1.53384 1.53945 1.54531 1.54671 1.55592 1.55999 1.57009 1.57112 1.59540 1.59843 1.60413 1.60661 1.62655 1.62787 1.63381 1.63939 1.64188 1.65896 1.66212 1.66508 1.67648 1.68312 1.69768 1.70570 1.70818 1.71695 1.72539 1.73864 1.74752 1.74927 1.75899 1.76975 1.77345 1.78665 1.79117 1.80553 1.80918 1.82353 1.82958 1.85379 1.86152 1.87092 1.88560 1.92164 1.93618 1.94323 1.95039 1.96229 1.97499 1.99164 1.99918 2.00078 2.00747 2.01406 2.02514 2.03390 2.03872 2.05264 2.08642 2.08794 2.12067 2.12852 2.14821 2.16027 2.18532 2.23353 2.26376 2.31638 2.32475 2.33815 2.34411 2.35776 2.49763 2.50232 2.50814 2.51019 2.51473 2.51660 2.51848 2.52006 2.52103 2.52375 2.52868 2.53352 2.53453 2.53700 2.54046 2.54190 2.54424 2.54539 2.54567 2.54737 2.54948 2.55097 2.55821 2.55967 2.56201 2.56454 2.57306 2.57762 2.58078 2.58121 2.58635 2.58965 2.59142 2.59559 2.60000 2.60058 2.60379 2.60464 2.61029 2.61408 2.61960 2.62120 2.62132 2.62320 2.62470 2.62860 2.63106 2.63477 2.63981 2.64269 2.64423 2.64684 2.65074 2.65482 2.65673 2.65949 2.66598 2.67094 2.67518 2.67846 2.68444 2.68650 2.69027 2.69086 2.69714 2.69882 2.70488 2.70987 2.71457 2.72076 2.72998 2.73129 2.73775 2.74233 2.75247 2.75648 2.76353 2.76544 2.77221 2.78656 2.79094 2.79311 2.81021 2.82106 2.82224 2.82986 2.83397 2.84469 2.85860 2.87467 2.87988 2.89922 2.91537 2.91728 2.91859 2.92743 2.93248 2.94243 2.94533 2.95475 2.96354 2.97093 2.97134 2.98383 3.00343 3.09934 3.13309 3.14429 3.15505 3.16261 3.16662 3.17428 24.74028 24.75619 24.79370 24.82492 24.83235 24.85490 24.88991 84.93630 84.94727 84.95951 84.96407 84.97047 84.98087 84.99213 -88.46225 -88.46078 -88.45940 -88.45578 -88.44465 -88.44393 -88.44309 -88.43826 -88.43364 -88.43009 -88.42933 -88.42867 -88.42823 -88.42483 -88.42449 -88.42178 -88.42113 -88.41949 -88.41687 -88.41600 -88.41504 -88.41468 -88.41429 -88.41100 -7.85715 -7.85543 -7.85535 -7.85003 -7.84013 -7.83916 -7.83662 -7.83435 -7.82982 -7.82625 -7.82515 -7.82299 -7.82260 -7.82116 -7.81884 -7.81737 -7.81592 -7.81504 -7.81297 -7.81237 -7.81121 -7.81077 -7.80937 -7.80743 -5.76879 -5.76824 -5.76620 -5.76581 -5.76409 -5.76400 -5.76393 -5.76328 -5.76246 -5.76186 -5.75896 -5.75619 -5.75028 -5.74983 -5.74927 -5.74899 -5.74845 -5.74778 -5.74746 -5.74585 -5.74552 -5.74302 -5.74273 -5.74167 -5.74048 -5.73903 -5.73736 -5.73647 -5.73541 -5.73493 -5.73429 -5.73413 -5.73359 -5.73338 -5.73280 -5.73217 -5.73192 -5.73107 -5.73106 -5.73096 -5.73068 -5.72920 -5.72881 -5.72789 -5.72745 -5.72702 -5.72690 -5.72600 -5.72554 -5.72536 -5.72512 -5.72432 -5.72408 -5.72339 -5.72333 -5.72253 -5.72244 -5.72231 -5.72218 -5.72188 -5.72101 -5.72047 -5.72040 -5.72031 -5.71969 -5.71828 -5.71824 -5.71819 -5.71803 -5.71657 -5.71477 -5.71474 -2.52510 -2.51023 -2.50350 -2.49721 -2.49632 -2.49415 -2.49188 -1.54741 -1.54519 -1.54270 -1.53214 -1.53148 -1.52955 -1.52772 -1.52291 -1.52212 -1.52115 -1.51934 -1.51769 -1.51650 -1.51644 -1.51621 -1.51505 -1.51442 -1.51400 -1.51386 -1.51226 -1.51144 -0.65251 -0.63881 -0.62997 -0.61881 -0.61152 -0.60545 -0.59830 -0.59509 -0.59132 -0.58619 -0.58473 -0.58025 -0.57578 -0.57496 -0.57409 -0.57271 -0.56978 -0.56929 -0.56723 -0.56368 -0.56094 -0.55746 -0.55607 -0.55537 -0.36323 -0.34499 -0.34185 -0.33327 -0.31430 -0.29674 -0.29470 -0.29411 -0.29148 -0.28494 -0.28250 -0.27999 -0.27586 -0.27480 -0.27153 -0.27021 -0.26816 -0.26501 -0.26179 -0.26084 -0.25844 -0.25619 -0.25483 -0.25257 -0.25099 -0.24766 -0.24544 -0.24385 -0.24316 -0.23978 -0.23912 -0.23581 -0.23524 -0.23292 -0.23189 -0.22963 -0.22746 -0.22565 -0.22357 -0.22258 -0.22140 -0.21874 -0.21849 -0.21672 -0.21150 -0.20902 -0.20767 -0.20628 -0.20298 -0.20213 -0.19642 -0.19535 -0.19165 -0.19039 -0.18498 -0.18271 -0.18085 -0.17722 -0.17588 -0.17154 -0.16777 -0.16566 -0.16193 -0.15620 -0.15290 -0.15219 -0.15136 -0.14894 -0.14625 -0.14432 -0.14110 -0.13319 -0.10926 -0.10144 -0.09160 -0.08848 -0.08554 -0.08150 -0.07522 -0.07393 -0.07155 -0.07022 -0.06740 -0.06215 -0.06003 -0.05781 -0.05574 -0.05374 -0.05237 -0.04818 -0.04377 -0.04011 -0.03752 -0.03190 -0.01685 -0.01236 -0.00938 -0.00047 0.00225 0.00943 0.01706 0.01957 0.02121 0.02229 0.02527 0.03424 0.04638 0.07728 0.08172 0.08652 0.09259 0.10792 0.11411 0.12244 0.12624 0.13097 0.13264 0.13418 0.14162 0.14291 0.14843 0.15080 0.15675 0.15906 0.16077 0.16691 0.16798 0.17182 0.17638 0.17892 0.18185 0.18548 0.18854 0.19153 0.19543 0.19962 0.20255 0.20496 0.21496 0.21693 0.22257 0.23116 0.23426 0.24388 0.24764 0.25051 0.25277 0.26000 0.26114 0.26986 0.27107 0.27441 0.27989 0.28205 0.28591 0.28840 0.29196 0.29413 0.29819 0.30405 0.30643 0.30900 0.31680 0.32057 0.32423 0.32515 0.32902 0.33111 0.33521 0.34169 0.34285 0.34762 0.35018 0.35643 0.36114 0.36442 0.36537 0.36957 0.37436 0.38083 0.38250 0.38761 0.39236 0.39371 0.40013 0.40164 0.40786 0.41073 0.41521 0.42002 0.42516 0.42973 0.43285 0.43673 0.44261 0.44600 0.45235 0.46696 0.46818 0.47142 0.47900 0.48334 0.49276 0.49577 0.50771 0.51183 0.51373 0.52198 0.52367 0.53453 0.53715 0.53778 0.54423 0.55021 0.55079 0.55305 0.55619 0.56148 0.56177 0.56483 0.56932 0.57039 0.57722 0.57816 0.58278 0.58788 0.58936 0.59015 0.59272 0.59562 0.59821 0.60117 0.60423 0.60666 0.61105 0.61329 0.61362 0.61494 0.61550 0.62031 0.62256 0.62524 0.62677 0.62958 0.63220 0.63558 0.63897 0.64122 0.64440 0.64618 0.64866 0.65228 0.65322 0.65415 0.65865 0.65976 0.66224 0.66399 0.66527 0.66997 0.67035 0.67388 0.67671 0.67996 0.68033 0.68111 0.68467 0.68895 0.69019 0.69152 0.69400 0.69548 0.69938 0.70128 0.70472 0.70807 0.70972 0.71120 0.71601 0.71777 0.72078 0.72395 0.73144 0.73423 0.73562 0.73664 0.74324 0.74954 0.75137 0.75262 0.75811 0.76359 0.76897 0.77042 0.77571 0.77838 0.78664 0.78782 0.79429 0.80079 0.80488 0.81242 0.81416 0.81737 0.82677 0.82891 0.83386 0.83872 0.84290 0.84640 0.85001 0.85253 0.85381 0.85540 0.85741 0.86352 0.86591 0.86884 0.86983 0.87586 0.87777 0.87959 0.88468 0.88508 0.88764 0.89263 0.89517 0.89701 0.89841 0.89945 0.90575 0.91065 0.91360 0.91667 0.91985 0.92062 0.92792 0.93056 0.93410 0.93486 0.93657 0.93754 0.94152 0.94271 0.94770 0.95121 0.95319 0.96321 0.96577 0.97053 0.97411 0.97556 0.97985 0.98288 0.98711 0.99040 0.99249 0.99466 0.99779 1.00437 1.00647 1.01043 1.01319 1.01784 1.02092 1.02753 1.03410 1.03963 1.04414 1.04796 1.05085 1.05733 1.06004 1.06794 1.07085 1.07444 1.08187 1.08274 1.08891 1.09114 1.09516 1.10008 1.10589 1.10727 1.10820 1.11476 1.11778 1.12467 1.12589 1.12981 1.13294 1.13888 1.14390 1.14545 1.15080 1.15614 1.15822 1.15984 1.16184 1.16553 1.16654 1.16965 1.17454 1.17532 1.18203 1.18421 1.18764 1.19221 1.19532 1.19951 1.20123 1.20342 1.20607 1.20963 1.21171 1.21274 1.21885 1.22035 1.22796 1.22971 1.23272 1.23658 1.23852 1.24420 1.24658 1.24969 1.25166 1.26179 1.26368 1.26901 1.27108 1.27844 1.27945 1.28114 1.28630 1.28954 1.29792 1.29852 1.30663 1.30869 1.31477 1.32019 1.32256 1.32769 1.34036 1.34383 1.34704 1.35068 1.35273 1.35800 1.36647 1.37642 1.38034 1.38538 1.39057 1.39207 1.40154 1.40830 1.41634 1.42503 1.42992 1.43619 1.44319 1.44456 1.44953 1.45936 1.46225 1.46565 1.47076 1.47431 1.48479 1.49144 1.49635 1.50275 1.50667 1.51319 1.51790 1.52323 1.53187 1.53384 1.53945 1.54531 1.54671 1.55592 1.55999 1.57009 1.57112 1.59540 1.59843 1.60413 1.60661 1.62655 1.62787 1.63381 1.63939 1.64188 1.65896 1.66212 1.66508 1.67648 1.68312 1.69768 1.70570 1.70818 1.71695 1.72539 1.73864 1.74752 1.74927 1.75899 1.76975 1.77345 1.78665 1.79117 1.80553 1.80918 1.82353 1.82958 1.85379 1.86152 1.87092 1.88560 1.92164 1.93618 1.94323 1.95039 1.96229 1.97499 1.99164 1.99918 2.00078 2.00747 2.01406 2.02514 2.03390 2.03872 2.05264 2.08642 2.08794 2.12067 2.12852 2.14821 2.16027 2.18532 2.23353 2.26376 2.31638 2.32475 2.33815 2.34411 2.35776 2.49763 2.50232 2.50814 2.51019 2.51473 2.51660 2.51848 2.52006 2.52103 2.52375 2.52868 2.53352 2.53453 2.53700 2.54046 2.54190 2.54424 2.54539 2.54567 2.54737 2.54948 2.55097 2.55821 2.55967 2.56201 2.56454 2.57306 2.57762 2.58078 2.58121 2.58635 2.58965 2.59142 2.59559 2.60000 2.60058 2.60379 2.60464 2.61029 2.61408 2.61960 2.62120 2.62132 2.62320 2.62470 2.62860 2.63106 2.63477 2.63981 2.64269 2.64423 2.64684 2.65074 2.65482 2.65673 2.65949 2.66598 2.67094 2.67518 2.67846 2.68444 2.68650 2.69027 2.69086 2.69714 2.69882 2.70488 2.70987 2.71457 2.72076 2.72998 2.73129 2.73775 2.74233 2.75247 2.75648 2.76353 2.76544 2.77221 2.78656 2.79094 2.79311 2.81021 2.82106 2.82224 2.82986 2.83397 2.84469 2.85860 2.87467 2.87988 2.89922 2.91537 2.91728 2.91859 2.92743 2.93248 2.94243 2.94533 2.95475 2.96354 2.97093 2.97134 2.98383 3.00343 3.09934 3.13309 3.14429 3.15505 3.16261 3.16662 3.17428 24.74028 24.75619 24.79370 24.82492 24.83235 24.85490 24.88991 84.93630 84.94727 84.95951 84.96407 84.97047 84.98087 84.99213 1-A. -1.73350330e+00 3.51322885e-01 6.24275192e-01 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] -4.4061 0.8930 1.5867 4.7675 -527.9899 -559.7876 -491.3109 -3.3794 -0.3293 0.2833 -1.6271 -33.4248 35.0519 -3.3794 -0.3293 0.2833 -71.0164 31.4043 5.5089 3.3066 -42.6132 0.7588 -20.9296 21.5116 0.5294 -5.3080 -25741.7698 -26206.5862 -4639.3177 -59.7273 25.5454 -97.2309 -80.4296 39.1221 -0.7168 -8628.0000 -5031.1007 -5022.6577 -133.0645 29.8468 12.7315 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|Beta|Orbitals: (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|Beta|Orbitals: (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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 -10036.0362848 0. 0. 0. 6.841E-9 1.7E-5 -25.0186893,-1.0356661,26.0543555,-1.4521875,0.6801892,-0.0271176 C01 [X(H5Mo7S24)] -0.0515927 -1.7624083 0.639872 -0.000007540 0.000000238 0.000011731 -0.000022950 0.000002204 0.000020748 -0.000003890 0.000009338 0.000016133 0.000018019 -0.000007653 0.000009020 -0.000004595 -0.000002083 0.000021978 0.000013486 -0.000000623 0.000004343 -0.000013487 0.000000433 -0.000043161 0.000003710 0.000019499 0.000004450 0.000000941 -0.000007677 -0.000002892 -0.000005397 0.000006092 0.000020328 -0.000002599 0.000023742 -0.000009955 0.000006104 -0.000030691 -0.000059179 -0.000002318 -0.000020676 -0.000001222 -0.000022858 0.000010389 0.000006991 0.000000988 -0.000009848 0.000014167 -0.000006433 0.000015938 -0.000002202 0.000046583 -0.000060526 -0.000021014 0.000008900 0.000018677 0.000002234 -0.000008334 0.000007635 -0.000006723 -0.000005636 0.000025300 -0.000006058 -0.000009671 0.000002659 -0.000032174 -0.000018369 -0.000040551 -0.000005474 0.000022482 -0.000002036 0.000038071 0.000006042 0.000029946 -0.000015868 0.000014515 0.000008189 0.000011399 0.000003494 -0.000001302 0.000013027 0.000009094 -0.000019025 0.000043033 0.000004501 0.000012020 -0.000004457 -0.000003912 -0.000004496 0.000009325 -0.000007222 -0.000003416 -0.000002015 0.000001246 0.000003688 -0.000007488 0.000001919 0.000001461 -0.000013836 0.000011914 0.000006343 -0.000004829 -0.000016175 0.000008842 0.000014319 -0.000001777 0.000004141 -0.000005479 -0.000010772 -0.000006168 -0.000017276 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.0121,.2614,-.7559;2.7669,2.5367,.3686;.4924,1.8434,-2.0775;1.0472,3.7534,1.1406;4.2876,2.8947,1.7839;3.1076,4.0242,-1.5235;.7026,-3.7887,-.0802;1.3386,-1.4905,-1.406;2.6461,-2.7271,1.3843;.329,-5.2918,1.3603;2.329,-4.7916,-1.3885;-3.6397,1.326,.1217;-1.9554,-.6163,-1.3627;-3.6474,-.903,1.5571;-4.5074,2.4678,1.6935;-5.2204,.4462,-1.0318;-2.7822,-2.834,.1529;-.4486,-2.0048,1.3182;-1.1888,-3.7862,-1.3845;-4.5418,-2.8489,-1.0352;-2.9372,-4.346,1.6563;-1.1378,3.8388,-.0554;-1.184,1.4626,1.0711;-2.8584,2.9006,-1.3964;-.3431,5.1893,-1.523;-2.2204,4.9674,1.3741;3.8307,-.7848,-.063;1.8151,.4572,1.0936;3.8772,1.1211,-1.3355;4.722,-2.2372,-1.3902;5.1763,-.4701,1.5602;3.5963,-3.6537,1.1345;2.8637,-3.6867,-1.9845;2.5261,5.1254,-.9984;-2.576,-.6585,2.3437;-.4697,-2.6064,2.5305;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3 Gaussian 16 GINC-C0312 RABBANI15 Checking optimization ES64L-G16RevC.02 102 C1[X(H5Mo7S24)] UM06L Gen/Auto Freq #P Geom=AllCheck Guess=TCheck SCRF=Check GenChk UM06L/Gen/Auto 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 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.0121,.2614,-.7559;2.7669,2.5367,.3686;.4924,1.8434,-2.0775;1.0472,3.7534,1.1406;4.2876,2.8947,1.7839;3.1076,4.0242,-1.5235;.7026,-3.7887,-.0802;1.3386,-1.4905,-1.406;2.6461,-2.7271,1.3843;.329,-5.2918,1.3603;2.329,-4.7916,-1.3885;-3.6397,1.326,.1217;-1.9554,-.6163,-1.3627;-3.6474,-.903,1.5571;-4.5074,2.4678,1.6935;-5.2204,.4462,-1.0318;-2.7822,-2.834,.1529;-.4486,-2.0048,1.3182;-1.1888,-3.7862,-1.3845;-4.5418,-2.8489,-1.0352;-2.9373,-4.346,1.6563;-1.1378,3.8388,-.0554;-1.184,1.4626,1.0711;-2.8584,2.9006,-1.3964;-.3431,5.1893,-1.523;-2.2204,4.9674,1.3741;3.8307,-.7848,-.063;1.8151,.4572,1.0936;3.8772,1.1211,-1.3355;4.722,-2.2372,-1.3902;5.1763,-.4701,1.5602;3.5963,-3.6537,1.1345;2.8637,-3.6867,-1.9845;2.5261,5.1254,-.9984;-2.576,-.6585,2.3437;-.4697,-2.6064,2.5305;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3 Checking optimization 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 98 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 98 32 32 32 32 1 1 1 1 1 97.9055000 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 97.9055000 31.9720718 31.9720718 31.9720718 31.9720718 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 0 0 0 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 1 206.6400000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 206.6400000 13.6000000 13.6000000 13.6000000 13.6000000 1.0000000 1.0000000 1.0000000 1.0000000 1.0000000 (Enter /apps/gaussian/g16c02/g16/l101.exe) Structure from the checkpoint file: "01.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 1 1 1 1 1 2 2 2 2 2 4 6 7 7 7 7 7 9 9 11 12 12 12 12 12 14 14 17 17 17 17 18 22 22 22 22 27 27 27 27 3 8 13 23 28 4 5 6 28 29 22 34 9 10 11 18 19 27 32 33 14 15 16 23 24 17 35 18 19 20 21 36 23 24 25 26 28 29 30 31 2.1166 2.2915 2.2382 2.4923 2.5904 2.2436 2.1081 2.4308 2.3991 2.478 2.4924 1.3515 2.655 2.1152 2.3157 2.5423 2.2975 2.6964 1.3505 1.3646 2.6513 2.1277 2.1455 2.6363 2.3226 2.5395 1.3515 2.737 2.4103 2.1232 2.1378 1.3536 2.6301 2.3746 2.1469 2.1188 2.6349 2.2922 2.16 2.1317 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|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 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 3 3 3 3 8 8 8 13 13 23 4 4 4 4 5 5 5 6 6 28 2 2 9 9 9 9 10 10 10 11 11 18 7 7 27 7 14 14 14 14 15 15 15 16 16 23 12 12 17 14 14 14 14 18 18 18 19 19 20 7 7 17 7 4 4 4 4 23 23 23 24 24 25 1 1 12 12 9 9 9 9 28 28 28 29 29 30 1 1 2 2 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 4 6 7 7 7 7 7 7 7 7 7 7 9 9 9 11 12 12 12 12 12 12 12 12 12 12 14 14 14 17 17 17 17 17 17 17 17 17 17 18 18 18 19 22 22 22 22 22 22 22 22 22 22 23 23 23 24 27 27 27 27 27 27 27 27 27 27 28 28 28 29 8 13 23 28 13 23 28 23 28 28 5 6 28 29 6 28 29 28 29 29 22 34 10 11 18 19 11 18 19 18 19 19 27 32 32 33 15 16 23 24 16 23 24 23 24 24 17 35 35 18 19 20 21 19 20 21 20 21 21 17 36 36 17 23 24 25 26 24 25 26 25 26 26 12 22 22 22 28 29 30 31 29 30 31 30 31 31 2 27 27 27 105.2436 108.8604 101.9099 103.3776 97.5956 148.6747 81.8033 88.0425 146.6251 76.9509 103.2871 92.4889 93.5534 152.8561 108.5171 103.3249 103.6188 145.2091 75.6102 83.7097 121.6947 97.8097 92.1629 88.3224 75.3714 156.2514 101.5987 92.523 104.0049 158.8581 104.9484 86.4859 108.2718 97.9671 94.9243 99.8589 92.8667 86.7984 81.4468 157.646 108.4664 94.9366 104.8471 154.303 100.0462 83.5089 109.8118 99.2443 100.9128 79.9042 151.4416 91.8571 97.1366 80.0724 161.2563 88.6664 100.8449 102.5401 109.1743 86.5206 100.8254 103.4934 100.5185 77.229 153.2134 91.4358 98.1853 82.6582 150.1812 100.5617 97.51 102.7817 108.3768 99.0972 96.4907 84.7737 98.1898 76.5779 154.9398 91.5342 88.5648 82.373 154.4673 94.5333 102.0977 106.6871 107.8579 97.2322 100.5662 88.4217 94.826 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|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 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 3 3 8 8 13 13 28 28 3 3 8 8 13 13 23 23 5 6 28 29 4 5 28 29 4 4 5 5 6 6 29 29 4 5 6 28 2 2 2 2 10 10 11 11 18 18 19 19 9 10 18 19 9 9 10 10 11 11 19 19 9 10 11 18 7 7 7 7 32 32 32 32 15 15 16 16 23 23 24 24 14 14 15 15 16 16 24 24 14 15 16 23 12 12 12 12 35 35 35 35 14 14 19 19 20 20 21 21 14 18 20 21 4 4 24 24 25 25 26 26 4 23 25 26 9 9 29 29 30 30 31 31 9 28 30 31 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 4 4 4 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 9 9 9 9 9 9 9 9 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 12 14 14 14 14 14 14 14 14 17 17 17 17 17 17 17 17 17 17 17 17 22 22 22 22 22 22 22 22 22 22 22 22 27 27 27 27 27 27 27 27 27 27 27 27 23 23 23 23 23 23 23 23 28 28 28 28 28 28 28 28 4 4 4 4 6 6 6 6 28 28 28 28 28 28 28 28 29 29 29 29 22 22 22 22 9 9 9 9 9 9 9 9 11 11 11 11 18 18 18 18 18 18 18 18 19 19 19 19 27 27 27 27 27 27 27 27 14 14 14 14 14 14 14 14 23 23 23 23 23 23 23 23 24 24 24 24 17 17 17 17 17 17 17 17 18 18 18 18 18 18 18 18 19 19 19 19 23 23 23 23 23 23 23 23 24 24 24 24 28 28 28 28 28 28 28 28 29 29 29 29 12 22 12 22 12 22 12 22 2 27 2 27 2 27 2 27 22 22 22 22 34 34 34 34 1 27 1 27 1 27 1 27 27 27 27 27 23 24 25 26 27 32 27 32 27 32 27 32 33 33 33 33 17 36 17 36 17 36 17 36 17 17 17 17 28 29 30 31 28 29 30 31 17 35 17 35 17 35 17 35 1 22 1 22 1 22 1 22 22 22 22 22 18 19 20 21 18 19 20 21 7 36 7 36 7 36 7 36 7 7 7 7 1 12 1 12 1 12 1 12 12 12 12 12 1 2 1 2 1 2 1 2 2 2 2 2 89.5595 3.8393 -120.7404 153.5394 -19.3067 -105.0269 -169.2634 105.0164 8.0194 -81.7187 111.8344 22.0963 -156.785 113.4769 -91.3404 178.9215 179.4226 69.7347 -75.9856 7.1513 22.9802 -81.9218 122.843 178.2654 75.0985 175.5508 179.6561 -79.8916 -24.4355 76.0168 -77.7914 22.6608 -111.8857 75.8538 -178.1723 -26.3781 75.1292 32.8366 -77.025 174.178 173.7169 75.8143 72.1694 -25.7331 -94.239 167.8585 -52.8754 -150.7779 -68.2673 -160.1316 -29.1858 91.779 -177.3644 -74.2808 -85.7862 17.2974 141.9984 -114.918 18.0998 121.1834 -60.8249 70.74 177.0637 -20.987 86.4914 52.8489 -70.6724 -178.5024 -173.4328 152.9247 29.4034 -78.4266 177.1866 -77.5945 68.8354 174.0543 -88.2479 16.971 -40.0308 65.1881 90.9728 -173.27 -176.8625 -81.1053 27.2553 123.0125 -72.4426 23.3146 -74.0838 67.2378 179.5563 -26.1699 92.0235 45.9266 -71.0326 179.3802 -12.061 -58.1579 -175.1171 75.2957 -176.9945 82.6989 -17.4623 -117.7689 -111.9725 147.7209 85.5146 -14.792 65.7664 19.7003 -179.336 -66.6799 -86.4217 174.9869 75.7739 -22.8176 -16.5305 -115.122 177.4797 78.8883 67.7167 26.2874 176.211 -72.9355 -93.9309 169.0055 72.3739 -24.6896 -29.7626 -126.8261 178.6341 81.5705 56.8692 23.9342 178.4054 -68.5366 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|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. 0.00136 0.00278 0.00324 0.00401 0.00448 0.00512 0.00544 0.00649 0.00694 0.00706 0.00822 0.00877 0.00957 0.01102 0.01166 0.01258 0.01299 0.01388 0.01596 0.01751 0.01791 0.01865 0.02122 0.02245 0.02358 0.02575 0.02618 0.02950 0.03182 0.03321 0.03445 0.03566 0.03784 0.03832 0.04005 0.04098 0.04373 0.04396 0.04464 0.04735 0.04811 0.05165 0.05371 0.05391 0.05916 0.06017 0.06118 0.06365 0.06527 0.06583 0.06780 0.06911 0.07049 0.07256 0.07517 0.07804 0.07833 0.08099 0.08194 0.08554 0.09004 0.09444 0.09478 0.09837 0.10124 0.10388 0.10496 0.10836 0.11330 0.11973 0.12064 0.12558 0.12903 0.13540 0.14003 0.14570 0.14820 0.16343 0.17624 0.18037 0.18773 0.21766 0.22803 0.23104 0.23792 0.23906 0.24470 0.25812 0.26261 0.26576 0.26666 0.26819 0.26950 0.27377 0.27819 0.28098 0.28211 0.28463 0.29612 0.38471 0.40621 0.93022 Angle between quadratic step and forces= 68.34 degrees. 1 2 3 0.00144009 0.00000318 0.00000000 0.00000224 0.00000080 0.00000080 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 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 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 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 3.99978 4.33040 4.22954 4.70970 4.89512 4.23987 3.98370 4.59353 4.53369 4.68280 4.70992 2.55400 5.01721 3.99714 4.37605 4.80427 4.34173 5.09540 2.55216 2.57867 5.01025 4.02075 4.05440 4.98192 4.38899 4.79889 2.55395 5.17221 4.55476 4.01223 4.03983 2.55788 4.97016 4.48739 4.05710 4.00389 4.97929 4.33157 4.08173 4.02842 1.83685 1.89997 1.77866 1.80428 1.70336 2.59486 1.42774 1.53663 2.55909 1.34305 1.80270 1.61424 1.63282 2.66784 1.89398 1.80336 1.80849 2.53438 1.31965 1.46101 2.12397 1.70710 1.60855 1.54152 1.31548 2.72710 1.77323 1.61483 1.81523 2.77260 1.83170 1.50946 1.88970 1.70985 1.65674 1.74287 1.62083 1.51492 1.42152 2.75144 1.89310 1.65696 1.82993 2.69310 1.74614 1.45751 1.91658 1.73214 1.76126 1.39459 2.64315 1.60321 1.69535 1.39753 2.81445 1.54752 1.76007 1.78966 1.90545 1.51007 1.75974 1.80630 1.75438 1.34790 2.67408 1.59586 1.71366 1.44266 2.62116 1.75513 1.70187 1.79388 1.89153 1.72957 1.68408 1.47958 1.71373 1.33654 2.70421 1.59757 1.54575 1.43768 2.69596 1.64992 1.78194 1.86204 1.88248 1.69702 1.75521 1.54325 1.65503 1.56311 0.06701 -2.10732 2.67977 -0.33697 -1.83307 -2.95420 1.83288 0.13996 -1.42626 1.95188 0.38565 -2.73641 1.98055 -1.59419 3.12277 3.13151 1.21710 -1.32620 0.12481 0.40108 -1.42981 2.14401 3.11132 1.31072 3.06394 3.13559 -1.39437 -0.42648 1.32674 -1.35772 0.39551 -1.95277 1.32390 -3.10969 -0.46039 1.31125 0.57311 -1.34434 3.03998 3.03193 1.32321 1.25959 -0.44913 -1.64478 2.92968 -0.92285 -2.63157 -1.19149 -2.79482 -0.50939 1.60185 -3.09559 -1.29644 -1.49725 0.30190 2.47834 -2.00570 0.31590 2.11505 -1.06159 1.23465 3.09035 -0.36629 1.50956 0.92239 -1.23347 -3.11545 -3.02697 2.66904 0.51319 -1.36880 3.09249 -1.35428 1.20140 3.03782 -1.54022 0.29620 -0.69867 1.13775 1.58777 -3.02413 -3.08683 -1.41556 0.47570 2.14697 -1.26436 0.40692 -1.29301 1.17352 3.13385 -0.45675 1.60611 0.80157 -1.23975 3.13078 -0.21050 -1.01505 -3.05637 1.31416 -3.08914 1.44337 -0.30477 -2.05546 -1.95429 2.57822 1.49251 -0.25817 1.14784 0.34383 -3.13000 -1.16378 -1.50834 3.05410 1.32250 -0.39824 -0.28851 -2.00926 3.09761 1.37686 1.18188 0.45880 3.07546 -1.27296 -1.63940 2.94970 1.26316 -0.43092 -0.51945 -2.21353 3.11775 1.42367 0.99255 0.41773 3.11376 -1.19619 -0.00001 -0.00001 0.00001 -0.00002 -0.00001 -0.00002 0.00000 0.00001 -0.00000 -0.00000 -0.00000 0.00001 0.00000 0.00002 -0.00001 -0.00001 -0.00000 -0.00003 0.00000 0.00000 -0.00002 0.00001 -0.00000 0.00002 0.00001 0.00001 0.00000 0.00001 -0.00002 0.00000 -0.00002 -0.00001 -0.00000 -0.00001 0.00001 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00002 -0.00001 -0.00000 0.00001 -0.00000 -0.00000 -0.00000 0.00002 -0.00000 -0.00001 0.00001 -0.00001 0.00001 -0.00000 0.00001 -0.00001 -0.00000 -0.00001 -0.00003 0.00000 -0.00003 -0.00002 0.00002 0.00003 0.00003 -0.00002 0.00000 -0.00001 0.00000 0.00001 -0.00004 0.00001 -0.00001 0.00001 -0.00002 0.00001 -0.00000 0.00001 -0.00000 -0.00002 0.00001 0.00002 -0.00001 0.00001 -0.00006 0.00001 0.00001 0.00000 0.00001 -0.00001 0.00000 0.00000 -0.00002 0.00001 0.00000 -0.00000 0.00000 -0.00001 -0.00001 -0.00001 -0.00000 0.00001 0.00002 -0.00001 -0.00001 0.00002 0.00000 -0.00001 -0.00001 0.00000 0.00000 -0.00002 -0.00001 -0.00001 -0.00001 -0.00000 -0.00002 -0.00001 0.00003 -0.00001 -0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00000 -0.00002 0.00001 0.00001 -0.00002 -0.00001 -0.00002 -0.00001 -0.00003 -0.00002 -0.00003 -0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00001 -0.00001 0.00001 0.00001 -0.00001 -0.00002 -0.00001 -0.00000 -0.00001 -0.00001 -0.00001 -0.00001 0.00000 -0.00001 -0.00000 -0.00001 0.00000 -0.00001 0.00001 -0.00000 -0.00001 -0.00000 0.00001 0.00000 0.00002 -0.00001 0.00001 0.00001 0.00000 0.00002 -0.00002 -0.00001 -0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00002 0.00000 0.00000 0.00002 0.00001 -0.00000 -0.00001 0.00001 -0.00000 0.00000 -0.00001 -0.00001 -0.00003 0.00001 -0.00001 -0.00000 -0.00001 0.00001 0.00000 -0.00000 -0.00001 0.00000 -0.00000 0.00001 0.00001 0.00002 0.00001 -0.00000 -0.00001 0.00000 0.00000 0.00001 -0.00000 -0.00001 -0.00002 0.00001 -0.00000 0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00001 0.00001 0.00000 -0.00000 0.00002 0.00001 -0.00001 0.00000 -0.00000 0.00000 -0.00002 -0.00001 -0.00001 0.00000 0.00001 0.00000 -0.00001 -0.00001 -0.00001 0.00001 -0.00001 0.00001 -0.00002 -0.00000 -0.00000 0.00002 0.00002 -0.00001 -0.00001 -0.00000 0.00002 0.00002 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00000 -0.00000 -0.00002 -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 0.00010 -0.00173 0.00175 -0.00180 0.00109 -0.00057 0.00009 0.00004 0.00031 -0.00023 0.00111 0.00003 0.00204 0.00007 -0.00010 -0.00118 -0.00027 -0.00176 -0.00002 0.00031 0.00035 0.00041 -0.00019 0.00354 0.00021 0.00054 0.00003 0.00151 -0.00009 -0.00005 0.00009 -0.00002 -0.00024 -0.00041 0.00022 0.00002 -0.00093 0.00016 0.00015 -0.00052 0.00032 -0.00011 0.00012 -0.00014 -0.00049 -0.00007 0.00041 -0.00018 0.00023 0.00015 0.00011 0.00019 0.00004 -0.00051 0.00006 0.00016 0.00045 -0.00035 -0.00008 -0.00054 -0.00010 0.00024 0.00002 -0.00113 0.00035 0.00103 0.00091 -0.00112 0.00018 -0.00043 -0.00077 0.00150 0.00099 0.00006 -0.00035 0.00010 -0.00201 0.00085 -0.00011 0.00131 -0.00011 -0.00261 -0.00015 0.00242 0.00050 0.00037 -0.00161 -0.00082 0.00037 -0.00015 0.00086 -0.00067 -0.00050 0.00080 0.00009 -0.00022 0.00038 -0.00010 -0.00022 -0.00103 0.00036 -0.00164 -0.00111 -0.00015 0.00073 -0.00068 -0.00036 0.00124 0.00111 -0.00128 0.00026 -0.00005 -0.00017 -0.00167 -0.00085 -0.00066 -0.00001 0.00022 -0.00088 -0.00038 0.00223 -0.00035 -0.00135 0.00190 -0.00064 -0.00020 -0.00002 -0.00016 0.00096 0.00019 0.00008 -0.00025 0.00072 0.00117 0.00214 -0.00010 0.00086 -0.00039 0.00058 0.00011 -0.00018 0.00054 0.00025 0.00025 -0.00004 -0.00007 -0.00036 0.00006 -0.00007 0.00024 -0.00078 -0.00096 -0.00115 -0.00072 -0.00159 -0.00080 0.00019 -0.00066 0.00033 -0.00109 -0.00010 -0.00032 0.00067 0.00015 -0.00067 -0.00071 -0.00069 0.00035 -0.00150 -0.00122 -0.00091 0.00150 0.00166 0.00063 0.00079 0.00035 0.00051 0.00442 0.00458 0.00285 0.00308 0.00105 0.00280 -0.00079 -0.00265 -0.00046 -0.00233 0.00122 -0.00065 -0.00018 -0.00204 -0.00367 -0.00061 0.00018 0.00019 -0.00120 -0.00381 0.00023 0.00020 -0.00111 -0.00372 0.00033 0.00029 0.00161 0.00125 0.00161 0.00125 -0.00074 -0.00110 -0.00294 -0.00330 0.00134 0.00050 -0.00033 -0.00117 0.00230 0.00146 -0.00021 -0.00105 0.00344 -0.00140 -0.00139 0.00120 0.00017 -0.00001 -0.00034 0.00002 0.00138 0.00120 0.00088 0.00123 -0.00038 -0.00054 0.00020 0.00004 -0.00333 -0.00349 0.00008 -0.00008 -0.00038 -0.00039 -0.00023 -0.00037 -0.00054 0.00115 -0.00068 0.00101 -0.00329 -0.00160 -0.00041 0.00128 0.00073 -0.00089 0.00027 0.00016 0.00061 0.00074 -0.00082 -0.00069 0.00186 0.00199 -0.00126 -0.00113 0.00333 0.00072 -0.00083 -0.00119 0.00010 -0.00173 0.00175 -0.00180 0.00109 -0.00057 0.00009 0.00004 0.00031 -0.00023 0.00111 0.00003 0.00204 0.00007 -0.00010 -0.00118 -0.00027 -0.00176 -0.00002 0.00031 0.00035 0.00041 -0.00019 0.00354 0.00021 0.00054 0.00003 0.00151 -0.00009 -0.00005 0.00009 -0.00002 -0.00024 -0.00041 0.00022 0.00002 -0.00093 0.00016 0.00015 -0.00052 0.00032 -0.00011 0.00012 -0.00013 -0.00049 -0.00007 0.00041 -0.00018 0.00023 0.00015 0.00011 0.00019 0.00004 -0.00051 0.00006 0.00016 0.00045 -0.00035 -0.00008 -0.00054 -0.00010 0.00024 0.00002 -0.00113 0.00035 0.00102 0.00090 -0.00112 0.00018 -0.00043 -0.00077 0.00150 0.00099 0.00006 -0.00035 0.00010 -0.00201 0.00085 -0.00011 0.00131 -0.00011 -0.00261 -0.00015 0.00242 0.00049 0.00037 -0.00161 -0.00082 0.00037 -0.00015 0.00086 -0.00067 -0.00050 0.00079 0.00009 -0.00022 0.00038 -0.00010 -0.00022 -0.00103 0.00036 -0.00164 -0.00111 -0.00015 0.00073 -0.00067 -0.00036 0.00124 0.00111 -0.00128 0.00026 -0.00005 -0.00017 -0.00167 -0.00085 -0.00066 -0.00001 0.00022 -0.00088 -0.00039 0.00224 -0.00035 -0.00135 0.00190 -0.00065 -0.00020 -0.00002 -0.00016 0.00096 0.00019 0.00008 -0.00025 0.00072 0.00117 0.00214 -0.00010 0.00086 -0.00038 0.00058 0.00011 -0.00018 0.00054 0.00025 0.00025 -0.00004 -0.00007 -0.00036 0.00006 -0.00007 0.00025 -0.00077 -0.00096 -0.00115 -0.00072 -0.00159 -0.00080 0.00019 -0.00066 0.00033 -0.00109 -0.00010 -0.00032 0.00067 0.00015 -0.00067 -0.00071 -0.00068 0.00035 -0.00150 -0.00122 -0.00091 0.00150 0.00166 0.00063 0.00079 0.00035 0.00051 0.00442 0.00458 0.00284 0.00308 0.00105 0.00280 -0.00078 -0.00265 -0.00046 -0.00232 0.00122 -0.00065 -0.00018 -0.00204 -0.00367 -0.00061 0.00018 0.00019 -0.00120 -0.00381 0.00023 0.00020 -0.00111 -0.00372 0.00033 0.00029 0.00161 0.00125 0.00161 0.00125 -0.00074 -0.00110 -0.00294 -0.00330 0.00134 0.00050 -0.00033 -0.00117 0.00230 0.00146 -0.00021 -0.00105 0.00344 -0.00140 -0.00139 0.00120 0.00017 -0.00001 -0.00034 0.00002 0.00138 0.00120 0.00088 0.00123 -0.00038 -0.00054 0.00020 0.00004 -0.00333 -0.00349 0.00009 -0.00008 -0.00038 -0.00039 -0.00023 -0.00037 -0.00054 0.00115 -0.00068 0.00101 -0.00329 -0.00160 -0.00041 0.00128 0.00073 -0.00089 0.00027 0.00016 0.00061 0.00074 -0.00082 -0.00069 0.00186 0.00199 -0.00126 -0.00113 0.00333 0.00072 -0.00083 -0.00119 3.99989 4.32867 4.23129 4.70791 4.89621 4.23929 3.98379 4.59357 4.53400 4.68257 4.71103 2.55403 5.01925 3.99721 4.37595 4.80309 4.34146 5.09364 2.55214 2.57897 5.01060 4.02116 4.05421 4.98546 4.38920 4.79943 2.55397 5.17373 4.55467 4.01218 4.03992 2.55787 4.96992 4.48698 4.05732 4.00391 4.97836 4.33174 4.08188 4.02790 1.83717 1.89987 1.77878 1.80414 1.70287 2.59479 1.42815 1.53645 2.55932 1.34319 1.80281 1.61442 1.63286 2.66733 1.89404 1.80352 1.80894 2.53403 1.31957 1.46047 2.12388 1.70734 1.60856 1.54038 1.31583 2.72813 1.77414 1.61371 1.81541 2.77216 1.83092 1.51096 1.89069 1.70991 1.65640 1.74297 1.61882 1.51577 1.42140 2.75275 1.89299 1.65435 1.82978 2.69552 1.74663 1.45788 1.91496 1.73132 1.76163 1.39445 2.64401 1.60254 1.69485 1.39832 2.81454 1.54730 1.76045 1.78956 1.90523 1.50904 1.76010 1.80466 1.75327 1.34775 2.67480 1.59518 1.71330 1.44390 2.62227 1.75386 1.70213 1.79383 1.89136 1.72790 1.68323 1.47892 1.71372 1.33676 2.70333 1.59719 1.54798 1.43733 2.69462 1.65181 1.78130 1.86184 1.88246 1.69686 1.75617 1.54344 1.65511 1.56286 0.06773 -2.10615 2.68190 -0.33707 -1.83220 -2.95459 1.83346 0.14007 -1.42644 1.95242 0.38591 -2.73616 1.98051 -1.59426 3.12241 3.13157 1.21703 -1.32595 0.12404 0.40012 -1.43096 2.14330 3.10972 1.30991 3.06413 3.13493 -1.39404 -0.42757 1.32665 -1.35804 0.39617 -1.95262 1.32323 -3.11040 -0.46107 1.31160 0.57160 -1.34556 3.03907 3.03343 1.32487 1.26023 -0.44833 -1.64444 2.93019 -0.91843 -2.62699 -1.18865 -2.79174 -0.50834 1.60465 -3.09638 -1.29909 -1.49771 0.29957 2.47956 -2.00634 0.31572 2.11301 -1.06527 1.23404 3.09053 -0.36610 1.50836 0.91857 -1.23323 -3.11526 -3.02808 2.66532 0.51351 -1.36851 3.09410 -1.35303 1.20301 3.03907 -1.54095 0.29510 -0.70161 1.13445 1.58911 -3.02363 -3.08717 -1.41672 0.47799 2.14843 -1.26457 0.40587 -1.28956 1.17212 3.13246 -0.45555 1.60628 0.80156 -1.24009 3.13079 -0.20912 -1.01385 -3.05549 1.31539 -3.08951 1.44283 -0.30458 -2.05542 -1.95761 2.57473 1.49260 -0.25825 1.14746 0.34345 -3.13023 -1.16415 -1.50888 3.05525 1.32183 -0.39723 -0.29180 -2.01086 3.09720 1.37814 1.18261 0.45791 3.07574 -1.27281 -1.63879 2.95044 1.26235 -0.43160 -0.51760 -2.21155 3.11650 1.42255 0.99588 0.41845 3.11293 -1.19738 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000056 0.000012 0.008371 0.001441 0.000450 0.000300 0.001800 0.001200 YES YES NO NO -7.383007e-07 0.000000 3.745747 0.000000 2.116593 3.411387 0.000000 4.106436 2.243642 3.783184 0.000000 5.627212 2.108084 5.515438 3.413510 0.000000 4.932544 2.430789 3.449951 3.378808 3.688846 0.000000 4.163707 6.668858 5.979422 7.648093 7.809953 8.301086 0.000000 2.291550 4.626808 3.504521 5.836851 6.172676 5.792625 2.728341 0.000000 4.522087 5.362272 6.124683 6.679310 5.870167 7.365339 2.654993 3.320294 0.000000 5.951156 8.259060 7.921841 9.076342 9.103211 10.140217 2.115198 4.808482 3.456433 0.000000 5.594739 7.548771 6.918911 9.003225 8.542848 8.851160 2.315704 3.446566 3.471525 3.436008 0.000000 3.903752 6.524646 4.709330 5.375603 8.250241 7.450653 6.712475 5.920315 7.585052 7.815403 8.679409 0.000000 2.238178 5.936217 3.542910 5.863146 7.823278 6.869734 4.332898 3.408301 5.759778 5.873127 5.982493 2.968667 0.000000 4.483071 7.374806 6.155554 6.625355 8.799962 8.910540 5.470909 5.829699 6.554753 5.925502 7.714619 2.651310 3.386831 0.000000 5.594076 7.394282 6.293464 5.728151 8.805871 8.411858 8.332729 7.710411 8.846157 9.149471 10.437166 2.127688 5.036333 3.481487 0.000000 5.243017 8.374240 5.973362 7.412103 10.214011 9.077369 7.343178 6.849196 8.819788 8.333229 9.195428 2.145495 3.449458 3.316204 3.467288 0.000000 4.267964 7.725527 6.129886 7.683369 9.244516 9.194286 3.620771 4.606139 5.567226 4.144654 5.686207 4.247626 2.810545 2.539466 5.784341 4.255371 0.000000 3.106355 5.645006 5.217675 5.951959 6.830339 7.554455 2.542308 3.298414 3.178517 3.377991 4.775745 4.765417 3.374244 3.391661 6.051339 5.856607 2.737016 0.000000 4.268473 7.661584 5.915924 8.259646 9.201337 8.915138 2.297543 3.414454 4.847117 3.479215 3.658687 5.866030 3.261329 4.796924 7.720058 5.855875 2.410273 3.320542 0.000000 5.521751 9.186534 6.960366 8.919732 10.903911 10.295183 5.412851 6.046656 7.585117 5.952359 7.148904 4.425203 3.432417 3.362475 5.976124 3.364298 2.123178 4.796364 3.499000 0.000000 5.978705 9.031436 8.000705 9.041131 10.229502 10.803269 4.071218 5.984501 5.819637 3.413297 6.099406 5.917800 4.897860 3.516807 6.992442 5.950093 2.137786 3.433515 3.552050 3.472687 0.000000 3.822402 4.137864 3.275341 2.492384 5.806053 4.495907 7.846411 6.029723 7.713694 9.355352 9.395734 3.550267 4.714320 5.602052 4.036362 5.397213 6.875553 6.042241 7.740068 7.567820 8.553230 0.000000 2.492268 4.154170 3.587291 3.198634 5.700753 5.631317 5.697442 4.606504 5.685157 6.927773 7.583265 2.636320 3.292380 3.449712 3.527412 4.663363 4.675208 3.553076 5.794746 5.856572 6.095517 2.630095 0.000000 3.951706 5.906947 3.579040 4.734719 7.821840 6.072220 7.691608 6.074316 8.348856 9.212766 9.277972 2.322554 3.631167 4.879940 3.528998 3.425772 5.940743 6.102412 6.892107 6.001798 7.863749 2.374625 3.310597 0.000000 4.999889 4.504033 3.492925 3.330079 6.135541 3.642071 9.153103 6.889197 8.947434 10.891178 10.333292 5.338252 6.027403 7.584322 5.923982 6.820976 8.551670 7.735487 9.016257 9.081822 10.380678 2.146926 4.617870 3.403054 0.000000 5.627363 5.638424 5.388108 3.493545 6.842383 6.137826 9.344932 7.880283 9.104217 10.571154 11.116061 4.103921 6.223940 6.044132 3.402987 5.935405 7.916323 7.193949 9.235714 8.502217 9.345143 2.118768 3.667344 3.514859 3.459284 0.000000 4.019469 3.514315 4.702121 5.458233 4.142291 5.077643 4.336858 2.917520 2.696367 5.882184 4.479588 7.765058 5.932629 7.652467 9.120743 9.185627 6.926475 4.659169 5.995816 8.677772 7.838523 6.787002 5.611059 7.752725 7.432483 8.471579 0.000000 2.590386 2.399124 3.705016 3.384814 3.539924 4.609022 4.543535 3.204478 3.303768 5.943969 5.828875 5.608440 4.626317 5.648399 6.661568 7.349559 5.731729 3.352053 5.759464 7.474809 6.780300 4.634108 3.163255 5.832046 5.822114 6.058470 2.634926 0.000000 4.001792 2.478033 3.539713 4.590156 3.611747 3.009228 5.979979 3.642800 4.870511 7.809129 6.112329 7.659598 6.085938 8.311712 9.016106 9.127675 7.887120 5.960352 7.053269 9.312965 9.234553 5.845931 5.614665 6.967038 5.864834 7.701696 2.292171 3.254792 0.000000 5.369180 5.450306 5.917166 7.469739 6.049784 6.467496 4.503175 3.464819 3.499667 6.016182 3.500244 9.214124 6.871335 8.972932 10.808679 10.304368 7.684443 5.841600 6.110394 9.290742 8.508364 8.546111 7.391013 9.157507 8.990263 10.379934 2.159958 4.677528 3.463338 0.000000 5.706861 4.033142 6.365862 5.921514 3.487374 5.829896 5.806688 4.956498 3.395114 6.839903 5.956274 9.111375 7.708787 8.834309 10.120428 10.754021 8.420573 5.835483 7.757701 10.336124 8.992270 7.813116 6.665460 9.201110 8.485206 9.182128 2.131747 3.517827 3.550289 3.468972 0.000000 5.634522 6.292544 7.083018 7.833532 6.616768 8.139665 3.141168 4.028709 1.350544 3.661848 3.044048 8.842122 6.803150 7.759876 10.171282 9.961717 6.505414 4.371911 5.409246 8.460673 6.590774 8.942310 7.002270 9.540880 10.038908 10.402587 3.117619 4.480422 5.383207 3.106140 3.579525 0.000000 5.022726 6.654082 6.017722 8.271712 7.716404 7.728453 2.882124 2.735629 3.509573 4.493183 1.364571 8.476846 5.747785 7.917425 10.282871 9.129099 6.096855 4.970653 4.097851 7.512911 6.880450 8.738719 7.227362 8.745332 9.448734 10.583932 3.612213 5.267468 4.956137 2.430542 5.315922 3.204030 0.000000 5.480721 2.937375 4.009057 2.940273 3.977522 1.351520 9.144952 6.733990 8.206950 10.904552 9.926703 7.328518 7.292727 8.999211 7.986224 9.050114 9.636222 8.065689 9.662629 10.655845 11.251823 3.996158 5.609338 5.839657 2.917487 5.308769 6.124373 5.164720 4.239534 7.693067 6.699274 9.097708 8.873518 0.000000 4.141446 6.531167 5.934688 5.834316 7.749016 8.317752 5.140329 5.484157 5.698159 5.556379 7.420979 3.163418 3.758231 1.351490 3.731862 4.428000 3.094332 2.718436 5.060273 4.480980 3.768394 5.296126 2.838267 5.170625 7.357513 5.719825 6.844904 4.699888 7.638506 8.348314 7.794008 6.966349 7.582384 8.405613 0.000000 4.388266 6.449912 6.477644 6.684361 7.311095 8.555528 3.096470 4.473375 3.322084 3.036162 5.288325 5.596049 4.617905 3.734545 6.538462 6.676648 3.324500 1.353574 4.151675 5.417987 3.143097 6.976668 4.381437 7.173182 8.787493 7.859034 5.342053 4.083021 6.909145 6.516293 6.114121 4.424674 5.715186 9.011661 2.875027 0.000000 H5Mo7S24(1-) C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.2332,-.0673,-.7421;2.019,-3.138,.4462;1.7221,-.8237,-2.0425;3.4974,-1.6281,1.2001;2.1145,-4.6719,1.8891;3.4407,-3.7513,-1.4277;-3.879,-.0718,-.0889;-1.7091,-1.0995,-1.3849;-3.159,-2.1372,1.416;-5.3082,.5685,1.3328;-5.1281,-1.5342,-1.3787;1.8783,3.3751,.0844;-.3061,2.0066,-1.3883;-.3271,3.7736,1.501;3.1384,4.071,1.6513;1.2764,5.0583,-1.102;-2.3662,3.2126,.0952;-1.9379,.7953,1.3053;-3.5586,1.7704,-1.4239;-2.0854,4.9297,-1.1216;-3.8404,3.64,1.5832;3.947,.492,-.0308;1.6044,.9473,1.075;3.3116,2.3195,-1.4075;5.1567,-.5391,-1.4739;5.2301,1.3995,1.3901;-1.4297,-3.6497,.0045;.1201,-1.8454,1.1383;.4497,-4.0306,-1.2512;-3.0014,-4.3136,-1.32;-1.3493,-5.0001,1.652;-4.2277,-2.9267,1.1741;-4.1227,-2.2533,-1.9566;4.6196,-3.3493,-.903;-.2662,2.6905,2.307;-2.5346,.9361,2.512;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3 0.0383304 0.0377107 0.0217225 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 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 947 947 947 947 947 MxSgAt= 36 MxSgA2= 36. 1 open 1 1 1 -10036.0362847593 -10036.0362847598 -0.000000000437 -10036.0362847598 -0.000000000080 -10036.0362848 3 -0.0000 9.701680631070e+03 -4.823281427414e+04 1.624954491401e+04 Using DIIS extrapolation, IDIIS= 1040. NGot= 14763950080 LenX= 14761999925 LenY= 14761042463 Requested convergence on RMS density matrix=1.00D-08 within 350 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. -0.0000 Using compressed storage, NAtomX= 36. Will process 37 centers per pass. Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 Minotr: UHF open shell wavefunction. IDoAtm=111111111111111111111111111111111111 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. Density fitting will be used, IDenFit= 2 NucTyp= 0. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. 10820 words used for storage of precomputed grid. Two-electron integrals replicated using symmetry. MDV= 14763950080 using IRadAn= 1. Solving linear equations simultaneously, MaxMat= 0. FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=T KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 5 NGrid= 0 NMat0= 111 NMatS0= 111 NMatT0= 0 NMatD0= 111 NMtDS0= 0 NMtDT0= 0 Integrals replicated using symmetry in FoFCou. FoFJK: IHMeth= 1 ICntrl= 500 DoSepK=F KAlg= 0 I1Cent= 4 FoldK=F IRaf= 710000000 NMat= 111 IRICut= 1 DoRegI=T DoRafI=F ISym2E= 2 IDoP0=0 IntGTp=1. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. Defaulting to unpruned grid for atomic number 42. There are 111 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 108 vectors produced by pass 0 Test12= 2.95D-13 1.00D-09 XBig12= 2.02D+04 3.13D+01. AX will form 108 AO Fock derivatives at one time. 108 vectors produced by pass 1 Test12= 2.95D-13 1.00D-09 XBig12= 1.78D+04 1.01D+01. 108 vectors produced by pass 2 Test12= 2.95D-13 1.00D-09 XBig12= 7.43D+02 1.10D+00. 108 vectors produced by pass 3 Test12= 2.95D-13 1.00D-09 XBig12= 2.47D+01 1.82D-01. 108 vectors produced by pass 4 Test12= 2.95D-13 1.00D-09 XBig12= 5.13D-01 3.30D-02. 108 vectors produced by pass 5 Test12= 2.95D-13 1.00D-09 XBig12= 3.28D-03 2.32D-03. 108 vectors produced by pass 6 Test12= 2.95D-13 1.00D-09 XBig12= 2.05D-05 1.33D-04. 70 vectors produced by pass 7 Test12= 2.95D-13 1.00D-09 XBig12= 5.98D-08 5.98D-06. 6 vectors produced by pass 8 Test12= 2.95D-13 1.00D-09 XBig12= 1.73D-10 3.10D-07. 3 vectors produced by pass 9 Test12= 2.95D-13 1.00D-09 XBig12= 4.88D-13 1.54D-08. InvSVY: IOpt=1 It= 1 EMax= 2.84D-14 Solved reduced A of dimension 835 with 111 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 830.03 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 988.647 7.310 979.755 -5.123 3.334 521.676 3800.118 69.552 3818.238 -86.773 18.266 2773.155 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 Mo Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S Mo S S S S H H H H H 95 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 95 33 33 33 33 1 1 1 1 1 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 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 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 1 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 2 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 3 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 4 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 5 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 6 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 7 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 8 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 9 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 10 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 11 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 12 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 13 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 14 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 15 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 16 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 17 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 18 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 19 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 20 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 21 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 22 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 23 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 24 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 25 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 26 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 27 Mo 95 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 28 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 29 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 30 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 31 S 33 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 32 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 33 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 34 H 1 1.0 0.0 0.0 -0.0 1.0 0.0 0.0 0.0 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 35 H 1 (Enter /apps/gaussian/g16c02/g16/l716.exe) PT46896.200S 2025-07-25T12:53:49.000 -88.46225 -88.46078 -88.45940 -88.45578 -88.44465 -88.44393 -88.44309 -88.43826 -88.43364 -88.43009 -88.42933 -88.42867 -88.42823 -88.42483 -88.42449 -88.42178 -88.42113 -88.41949 -88.41687 -88.41600 -88.41504 -88.41468 -88.41429 -88.41100 -7.85715 -7.85543 -7.85535 -7.85003 -7.84012 -7.83916 -7.83662 -7.83435 -7.82982 -7.82625 -7.82515 -7.82299 -7.82260 -7.82116 -7.81884 -7.81737 -7.81592 -7.81504 -7.81297 -7.81237 -7.81121 -7.81077 -7.80937 -7.80743 -5.76879 -5.76824 -5.76620 -5.76581 -5.76409 -5.76400 -5.76393 -5.76328 -5.76246 -5.76186 -5.75896 -5.75619 -5.75028 -5.74983 -5.74927 -5.74899 -5.74845 -5.74778 -5.74746 -5.74585 -5.74552 -5.74302 -5.74273 -5.74167 -5.74048 -5.73903 -5.73736 -5.73647 -5.73541 -5.73493 -5.73429 -5.73413 -5.73358 -5.73338 -5.73280 -5.73217 -5.73192 -5.73107 -5.73106 -5.73096 -5.73068 -5.72920 -5.72881 -5.72789 -5.72745 -5.72702 -5.72690 -5.72600 -5.72554 -5.72536 -5.72512 -5.72432 -5.72408 -5.72339 -5.72333 -5.72253 -5.72244 -5.72231 -5.72218 -5.72188 -5.72101 -5.72047 -5.72040 -5.72031 -5.71969 -5.71828 -5.71824 -5.71819 -5.71803 -5.71657 -5.71477 -5.71474 -2.52510 -2.51023 -2.50350 -2.49721 -2.49632 -2.49415 -2.49188 -1.54741 -1.54519 -1.54270 -1.53214 -1.53148 -1.52955 -1.52772 -1.52291 -1.52212 -1.52115 -1.51934 -1.51769 -1.51650 -1.51644 -1.51621 -1.51505 -1.51442 -1.51400 -1.51386 -1.51226 -1.51144 -0.65251 -0.63881 -0.62997 -0.61881 -0.61152 -0.60545 -0.59830 -0.59509 -0.59132 -0.58619 -0.58473 -0.58025 -0.57578 -0.57496 -0.57409 -0.57271 -0.56978 -0.56929 -0.56723 -0.56368 -0.56094 -0.55746 -0.55607 -0.55537 -0.36323 -0.34499 -0.34185 -0.33327 -0.31430 -0.29674 -0.29470 -0.29411 -0.29148 -0.28494 -0.28250 -0.27999 -0.27586 -0.27480 -0.27153 -0.27021 -0.26816 -0.26501 -0.26179 -0.26084 -0.25844 -0.25619 -0.25483 -0.25257 -0.25099 -0.24766 -0.24544 -0.24385 -0.24316 -0.23978 -0.23912 -0.23581 -0.23524 -0.23292 -0.23189 -0.22963 -0.22746 -0.22565 -0.22357 -0.22258 -0.22140 -0.21874 -0.21849 -0.21672 -0.21150 -0.20902 -0.20767 -0.20628 -0.20298 -0.20213 -0.19642 -0.19535 -0.19165 -0.19039 -0.18498 -0.18271 -0.18085 -0.17722 -0.17588 -0.17154 -0.16777 -0.16566 -0.16193 -0.15620 -0.15290 -0.15219 -0.15136 -0.14894 -0.14625 -0.14432 -0.14110 -0.13319 -0.10926 -0.10144 -0.09160 -0.08848 -0.08554 -0.08150 -0.07522 -0.07393 -0.07155 -0.07022 -0.06740 -0.06215 -0.06003 -0.05781 -0.05574 -0.05374 -0.05237 -0.04818 -0.04377 -0.04011 -0.03752 -0.03190 -0.01685 -0.01236 -0.00938 -0.00047 0.00225 0.00943 0.01706 0.01957 0.02121 0.02229 0.02527 0.03424 0.04638 0.07728 0.08172 0.08652 0.09259 0.10792 0.11411 0.12244 0.12624 0.13097 0.13264 0.13418 0.14162 0.14291 0.14843 0.15080 0.15675 0.15906 0.16077 0.16691 0.16798 0.17182 0.17638 0.17892 0.18185 0.18548 0.18854 0.19153 0.19543 0.19962 0.20255 0.20496 0.21496 0.21693 0.22257 0.23116 0.23426 0.24388 0.24764 0.25051 0.25277 0.26000 0.26114 0.26986 0.27107 0.27441 0.27989 0.28205 0.28591 0.28840 0.29196 0.29413 0.29819 0.30405 0.30643 0.30900 0.31680 0.32057 0.32423 0.32515 0.32902 0.33111 0.33521 0.34169 0.34285 0.34762 0.35018 0.35643 0.36114 0.36442 0.36537 0.36957 0.37436 0.38083 0.38250 0.38761 0.39236 0.39371 0.40013 0.40164 0.40786 0.41073 0.41521 0.42002 0.42516 0.42973 0.43285 0.43673 0.44261 0.44600 0.45235 0.46696 0.46818 0.47142 0.47900 0.48334 0.49276 0.49577 0.50771 0.51183 0.51373 0.52198 0.52367 0.53453 0.53715 0.53778 0.54423 0.55021 0.55079 0.55305 0.55619 0.56148 0.56177 0.56483 0.56932 0.57039 0.57722 0.57816 0.58278 0.58788 0.58936 0.59015 0.59272 0.59562 0.59821 0.60117 0.60423 0.60666 0.61105 0.61329 0.61362 0.61494 0.61550 0.62031 0.62256 0.62524 0.62677 0.62958 0.63220 0.63558 0.63897 0.64122 0.64440 0.64618 0.64866 0.65228 0.65322 0.65415 0.65865 0.65976 0.66224 0.66399 0.66527 0.66997 0.67035 0.67388 0.67671 0.67996 0.68033 0.68111 0.68467 0.68895 0.69019 0.69152 0.69400 0.69548 0.69938 0.70128 0.70472 0.70807 0.70972 0.71120 0.71601 0.71777 0.72078 0.72395 0.73144 0.73423 0.73562 0.73664 0.74324 0.74954 0.75137 0.75262 0.75811 0.76359 0.76897 0.77042 0.77571 0.77838 0.78664 0.78782 0.79429 0.80079 0.80488 0.81242 0.81416 0.81737 0.82677 0.82891 0.83386 0.83872 0.84290 0.84640 0.85001 0.85253 0.85381 0.85540 0.85741 0.86352 0.86591 0.86884 0.86983 0.87586 0.87777 0.87959 0.88468 0.88508 0.88764 0.89263 0.89517 0.89701 0.89841 0.89945 0.90575 0.91065 0.91360 0.91667 0.91985 0.92062 0.92792 0.93056 0.93410 0.93486 0.93657 0.93754 0.94152 0.94271 0.94770 0.95121 0.95319 0.96321 0.96577 0.97053 0.97411 0.97556 0.97985 0.98288 0.98711 0.99040 0.99249 0.99466 0.99779 1.00437 1.00647 1.01043 1.01319 1.01784 1.02092 1.02753 1.03410 1.03963 1.04414 1.04796 1.05085 1.05733 1.06004 1.06794 1.07085 1.07444 1.08187 1.08274 1.08891 1.09114 1.09516 1.10008 1.10589 1.10727 1.10820 1.11476 1.11778 1.12467 1.12589 1.12981 1.13294 1.13888 1.14390 1.14545 1.15080 1.15614 1.15822 1.15984 1.16184 1.16553 1.16654 1.16965 1.17454 1.17532 1.18203 1.18421 1.18764 1.19221 1.19532 1.19951 1.20123 1.20342 1.20607 1.20963 1.21171 1.21274 1.21885 1.22035 1.22796 1.22971 1.23272 1.23658 1.23852 1.24420 1.24658 1.24969 1.25166 1.26179 1.26368 1.26901 1.27108 1.27844 1.27945 1.28114 1.28630 1.28954 1.29792 1.29852 1.30663 1.30869 1.31477 1.32019 1.32256 1.32769 1.34036 1.34383 1.34704 1.35068 1.35273 1.35800 1.36647 1.37642 1.38034 1.38538 1.39057 1.39207 1.40154 1.40830 1.41634 1.42503 1.42992 1.43619 1.44319 1.44456 1.44953 1.45936 1.46225 1.46565 1.47076 1.47431 1.48479 1.49144 1.49635 1.50275 1.50667 1.51319 1.51790 1.52323 1.53187 1.53384 1.53945 1.54531 1.54671 1.55592 1.55999 1.57009 1.57112 1.59540 1.59843 1.60413 1.60661 1.62655 1.62787 1.63381 1.63939 1.64188 1.65896 1.66212 1.66508 1.67648 1.68312 1.69768 1.70570 1.70818 1.71695 1.72539 1.73864 1.74752 1.74927 1.75899 1.76975 1.77345 1.78665 1.79117 1.80553 1.80918 1.82353 1.82958 1.85379 1.86152 1.87092 1.88560 1.92164 1.93618 1.94323 1.95039 1.96229 1.97499 1.99164 1.99918 2.00078 2.00747 2.01406 2.02514 2.03390 2.03872 2.05264 2.08642 2.08794 2.12067 2.12852 2.14821 2.16027 2.18532 2.23353 2.26376 2.31638 2.32475 2.33815 2.34411 2.35776 2.49763 2.50232 2.50814 2.51019 2.51473 2.51660 2.51848 2.52006 2.52103 2.52375 2.52868 2.53352 2.53453 2.53700 2.54046 2.54190 2.54424 2.54539 2.54567 2.54737 2.54948 2.55097 2.55821 2.55967 2.56201 2.56454 2.57306 2.57762 2.58078 2.58121 2.58635 2.58965 2.59142 2.59559 2.60000 2.60058 2.60379 2.60464 2.61029 2.61408 2.61960 2.62120 2.62132 2.62320 2.62470 2.62860 2.63106 2.63477 2.63981 2.64269 2.64423 2.64684 2.65074 2.65482 2.65673 2.65949 2.66598 2.67094 2.67518 2.67846 2.68444 2.68650 2.69027 2.69086 2.69714 2.69882 2.70488 2.70987 2.71457 2.72076 2.72998 2.73129 2.73775 2.74233 2.75247 2.75648 2.76353 2.76544 2.77221 2.78656 2.79094 2.79311 2.81021 2.82106 2.82224 2.82986 2.83397 2.84469 2.85860 2.87467 2.87988 2.89922 2.91537 2.91728 2.91859 2.92743 2.93248 2.94243 2.94533 2.95475 2.96354 2.97093 2.97134 2.98383 3.00343 3.09934 3.13309 3.14429 3.15505 3.16261 3.16662 3.17428 24.74028 24.75619 24.79370 24.82492 24.83235 24.85490 24.88991 84.93630 84.94727 84.95951 84.96407 84.97047 84.98087 84.99213 -88.46225 -88.46078 -88.45940 -88.45578 -88.44465 -88.44393 -88.44309 -88.43826 -88.43364 -88.43009 -88.42933 -88.42867 -88.42823 -88.42483 -88.42449 -88.42178 -88.42113 -88.41949 -88.41687 -88.41600 -88.41504 -88.41468 -88.41429 -88.41100 -7.85715 -7.85543 -7.85535 -7.85003 -7.84012 -7.83916 -7.83662 -7.83435 -7.82982 -7.82625 -7.82515 -7.82299 -7.82260 -7.82116 -7.81884 -7.81737 -7.81592 -7.81504 -7.81297 -7.81237 -7.81121 -7.81077 -7.80937 -7.80743 -5.76879 -5.76824 -5.76620 -5.76581 -5.76409 -5.76400 -5.76393 -5.76328 -5.76246 -5.76186 -5.75896 -5.75619 -5.75028 -5.74983 -5.74927 -5.74899 -5.74845 -5.74778 -5.74746 -5.74585 -5.74552 -5.74302 -5.74273 -5.74167 -5.74048 -5.73903 -5.73736 -5.73647 -5.73541 -5.73493 -5.73429 -5.73413 -5.73358 -5.73338 -5.73280 -5.73217 -5.73192 -5.73107 -5.73106 -5.73096 -5.73068 -5.72920 -5.72881 -5.72789 -5.72745 -5.72702 -5.72690 -5.72600 -5.72554 -5.72536 -5.72512 -5.72432 -5.72408 -5.72339 -5.72333 -5.72253 -5.72244 -5.72231 -5.72218 -5.72188 -5.72101 -5.72047 -5.72040 -5.72031 -5.71969 -5.71828 -5.71824 -5.71819 -5.71803 -5.71657 -5.71477 -5.71474 -2.52510 -2.51023 -2.50350 -2.49721 -2.49632 -2.49415 -2.49188 -1.54741 -1.54519 -1.54270 -1.53214 -1.53148 -1.52955 -1.52772 -1.52291 -1.52212 -1.52115 -1.51934 -1.51769 -1.51650 -1.51644 -1.51621 -1.51505 -1.51442 -1.51400 -1.51386 -1.51226 -1.51144 -0.65251 -0.63881 -0.62997 -0.61881 -0.61152 -0.60545 -0.59830 -0.59509 -0.59132 -0.58619 -0.58473 -0.58025 -0.57578 -0.57496 -0.57409 -0.57271 -0.56978 -0.56929 -0.56723 -0.56368 -0.56094 -0.55746 -0.55607 -0.55537 -0.36323 -0.34499 -0.34185 -0.33327 -0.31430 -0.29674 -0.29470 -0.29411 -0.29148 -0.28494 -0.28250 -0.27999 -0.27586 -0.27480 -0.27153 -0.27021 -0.26816 -0.26501 -0.26179 -0.26084 -0.25844 -0.25619 -0.25483 -0.25257 -0.25099 -0.24766 -0.24544 -0.24385 -0.24316 -0.23978 -0.23912 -0.23581 -0.23524 -0.23292 -0.23189 -0.22963 -0.22746 -0.22565 -0.22357 -0.22258 -0.22140 -0.21874 -0.21849 -0.21672 -0.21150 -0.20902 -0.20767 -0.20628 -0.20298 -0.20213 -0.19642 -0.19535 -0.19165 -0.19039 -0.18498 -0.18271 -0.18085 -0.17722 -0.17588 -0.17154 -0.16777 -0.16566 -0.16193 -0.15620 -0.15290 -0.15219 -0.15136 -0.14894 -0.14625 -0.14432 -0.14110 -0.13319 -0.10926 -0.10144 -0.09160 -0.08848 -0.08554 -0.08150 -0.07522 -0.07393 -0.07155 -0.07022 -0.06740 -0.06215 -0.06003 -0.05781 -0.05574 -0.05374 -0.05237 -0.04818 -0.04377 -0.04011 -0.03752 -0.03190 -0.01685 -0.01236 -0.00938 -0.00047 0.00225 0.00943 0.01706 0.01957 0.02121 0.02229 0.02527 0.03424 0.04638 0.07728 0.08172 0.08652 0.09259 0.10792 0.11411 0.12244 0.12624 0.13097 0.13264 0.13418 0.14162 0.14291 0.14843 0.15080 0.15675 0.15906 0.16077 0.16691 0.16798 0.17182 0.17638 0.17892 0.18185 0.18548 0.18854 0.19153 0.19543 0.19962 0.20255 0.20496 0.21496 0.21693 0.22257 0.23116 0.23426 0.24388 0.24764 0.25051 0.25277 0.26000 0.26114 0.26986 0.27107 0.27441 0.27989 0.28205 0.28591 0.28840 0.29196 0.29413 0.29819 0.30405 0.30643 0.30900 0.31680 0.32057 0.32423 0.32515 0.32902 0.33111 0.33521 0.34169 0.34285 0.34762 0.35018 0.35643 0.36114 0.36442 0.36537 0.36957 0.37436 0.38083 0.38250 0.38761 0.39236 0.39371 0.40013 0.40164 0.40786 0.41073 0.41521 0.42002 0.42516 0.42973 0.43285 0.43673 0.44261 0.44600 0.45235 0.46696 0.46818 0.47142 0.47900 0.48334 0.49276 0.49577 0.50771 0.51183 0.51373 0.52198 0.52367 0.53453 0.53715 0.53778 0.54423 0.55021 0.55079 0.55305 0.55619 0.56148 0.56177 0.56483 0.56932 0.57039 0.57722 0.57816 0.58278 0.58788 0.58936 0.59015 0.59272 0.59562 0.59821 0.60117 0.60423 0.60666 0.61105 0.61329 0.61362 0.61494 0.61550 0.62031 0.62256 0.62524 0.62677 0.62958 0.63220 0.63558 0.63897 0.64122 0.64440 0.64618 0.64866 0.65228 0.65322 0.65415 0.65865 0.65976 0.66224 0.66399 0.66527 0.66997 0.67035 0.67388 0.67671 0.67996 0.68033 0.68111 0.68467 0.68895 0.69019 0.69152 0.69400 0.69548 0.69938 0.70128 0.70472 0.70807 0.70972 0.71120 0.71601 0.71777 0.72078 0.72395 0.73144 0.73423 0.73562 0.73664 0.74324 0.74954 0.75137 0.75262 0.75811 0.76359 0.76897 0.77042 0.77571 0.77838 0.78664 0.78782 0.79429 0.80079 0.80488 0.81242 0.81416 0.81737 0.82677 0.82891 0.83386 0.83872 0.84290 0.84640 0.85001 0.85253 0.85381 0.85540 0.85741 0.86352 0.86591 0.86884 0.86983 0.87586 0.87777 0.87959 0.88468 0.88508 0.88764 0.89263 0.89517 0.89701 0.89841 0.89945 0.90575 0.91065 0.91360 0.91667 0.91985 0.92062 0.92792 0.93056 0.93410 0.93486 0.93657 0.93754 0.94152 0.94271 0.94770 0.95121 0.95319 0.96321 0.96577 0.97053 0.97411 0.97556 0.97985 0.98288 0.98711 0.99040 0.99249 0.99466 0.99779 1.00437 1.00647 1.01043 1.01319 1.01784 1.02092 1.02753 1.03410 1.03963 1.04414 1.04796 1.05085 1.05733 1.06004 1.06794 1.07085 1.07444 1.08187 1.08274 1.08891 1.09114 1.09516 1.10008 1.10589 1.10727 1.10820 1.11476 1.11778 1.12467 1.12589 1.12981 1.13294 1.13888 1.14390 1.14545 1.15080 1.15614 1.15822 1.15984 1.16184 1.16553 1.16654 1.16965 1.17454 1.17532 1.18203 1.18421 1.18764 1.19221 1.19532 1.19951 1.20123 1.20342 1.20607 1.20963 1.21171 1.21274 1.21885 1.22035 1.22796 1.22971 1.23272 1.23658 1.23852 1.24420 1.24658 1.24969 1.25166 1.26179 1.26368 1.26901 1.27108 1.27844 1.27945 1.28114 1.28630 1.28954 1.29792 1.29852 1.30663 1.30869 1.31477 1.32019 1.32256 1.32769 1.34036 1.34383 1.34704 1.35068 1.35273 1.35800 1.36647 1.37642 1.38034 1.38538 1.39057 1.39207 1.40154 1.40830 1.41634 1.42503 1.42992 1.43619 1.44319 1.44456 1.44953 1.45936 1.46225 1.46565 1.47076 1.47431 1.48479 1.49144 1.49635 1.50275 1.50667 1.51319 1.51790 1.52323 1.53187 1.53384 1.53945 1.54531 1.54671 1.55592 1.55999 1.57009 1.57112 1.59540 1.59843 1.60413 1.60661 1.62655 1.62787 1.63381 1.63939 1.64188 1.65896 1.66212 1.66508 1.67648 1.68312 1.69768 1.70570 1.70818 1.71695 1.72539 1.73864 1.74752 1.74927 1.75899 1.76975 1.77345 1.78665 1.79117 1.80553 1.80918 1.82353 1.82958 1.85379 1.86152 1.87092 1.88560 1.92164 1.93618 1.94323 1.95039 1.96229 1.97499 1.99164 1.99918 2.00078 2.00747 2.01406 2.02514 2.03390 2.03872 2.05264 2.08642 2.08794 2.12067 2.12852 2.14821 2.16027 2.18532 2.23353 2.26376 2.31638 2.32475 2.33815 2.34411 2.35776 2.49763 2.50232 2.50814 2.51019 2.51473 2.51660 2.51848 2.52006 2.52103 2.52375 2.52868 2.53352 2.53453 2.53700 2.54046 2.54190 2.54424 2.54539 2.54567 2.54737 2.54948 2.55097 2.55821 2.55967 2.56201 2.56454 2.57306 2.57762 2.58078 2.58121 2.58635 2.58965 2.59142 2.59559 2.60000 2.60058 2.60379 2.60464 2.61029 2.61408 2.61960 2.62120 2.62132 2.62320 2.62470 2.62860 2.63106 2.63477 2.63981 2.64269 2.64423 2.64684 2.65074 2.65482 2.65673 2.65949 2.66598 2.67094 2.67518 2.67846 2.68444 2.68650 2.69027 2.69086 2.69714 2.69882 2.70488 2.70987 2.71457 2.72076 2.72998 2.73129 2.73775 2.74233 2.75247 2.75648 2.76353 2.76544 2.77221 2.78656 2.79094 2.79311 2.81021 2.82106 2.82224 2.82986 2.83397 2.84469 2.85860 2.87467 2.87988 2.89922 2.91537 2.91728 2.91859 2.92743 2.93248 2.94243 2.94533 2.95475 2.96354 2.97093 2.97134 2.98383 3.00343 3.09934 3.13309 3.14429 3.15505 3.16261 3.16662 3.17428 24.74028 24.75619 24.79370 24.82492 24.83235 24.85490 24.88991 84.93630 84.94727 84.95951 84.96407 84.97047 84.98087 84.99213 1-A. -1.73350839e+00 3.51319842e-01 6.24279338e-01 9.88646706e+02 7.31041128e+00 9.79754600e+02 -5.12342599e+00 3.33402717e+00 5.21675549e+02 -7.2639 -3.5419 -0.0028 -0.0019 -0.0009 1.6817 30.0832 32.9506 34.2646 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 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 30.0431 32.9354 34.2450 41.3373 43.2816 50.7028 58.4866 64.2422 66.2431 67.7575 72.2156 73.6345 78.0139 84.0541 86.5295 89.4642 91.8187 94.6761 98.1448 99.9609 103.5208 106.5503 107.6715 111.0520 112.3569 114.6325 118.2657 118.6212 119.9556 123.4341 125.3072 130.6847 132.9622 133.5350 143.1615 147.5993 155.0744 158.3182 158.6098 163.6765 167.4604 171.6265 173.4904 174.8098 178.7277 185.6758 191.5268 196.7184 197.0939 198.3777 202.0829 209.0034 213.5945 223.0704 232.0316 235.4417 240.5861 248.6680 261.3571 266.1750 273.6202 278.5779 282.6671 298.2855 301.7901 308.4711 313.4662 327.9450 335.6518 345.9791 369.6685 371.6400 375.6546 381.8799 387.2616 402.3205 421.7133 426.3331 451.0599 475.2532 496.1683 506.9475 512.9981 518.7039 525.6928 528.4107 534.8648 539.0085 542.2007 551.5127 556.9544 559.5581 598.3795 621.5717 657.6105 673.6906 693.4717 2521.0676 2664.5718 2677.6089 2691.2697 2693.8989 28.4168 33.3086 39.2612 32.5670 36.5841 36.8751 34.8342 37.1835 29.5073 33.1212 35.5935 32.3641 32.1344 29.5390 31.2169 32.6124 31.8333 30.8177 26.0226 23.2847 31.2386 34.1441 33.6555 32.5631 27.8936 30.5266 28.6034 37.6932 33.2256 38.2880 21.5976 29.0226 23.2915 29.0630 15.3636 24.7500 22.6129 22.8112 17.1157 16.3147 22.8889 32.5419 28.0764 30.4953 26.4031 27.9945 30.2856 32.9952 30.6585 30.9347 29.9103 24.6162 20.4399 16.7974 23.4033 21.8034 21.1498 21.0984 19.3458 30.0262 19.4420 17.7052 8.5658 5.3138 5.1909 8.8764 4.8983 17.8365 27.0630 23.9143 8.9669 24.8049 1.4672 11.9418 6.5602 7.7609 26.4178 28.0346 1.1630 1.1719 11.3181 27.9847 11.7985 17.3063 30.0866 32.9565 11.3638 22.4055 28.0504 27.0014 1.1691 13.5116 1.1295 1.0632 1.0697 1.0499 1.0520 1.0384 1.0377 1.0377 1.0378 1.0377 0.0151 0.0213 0.0271 0.0328 0.0404 0.0559 0.0702 0.0904 0.0763 0.0896 0.1094 0.1034 0.1152 0.1230 0.1377 0.1538 0.1581 0.1628 0.1477 0.1371 0.1972 0.2284 0.2299 0.2366 0.2075 0.2363 0.2357 0.3125 0.2817 0.3437 0.1998 0.2920 0.2426 0.3053 0.1855 0.3177 0.3204 0.3369 0.2537 0.2575 0.3782 0.5648 0.4979 0.5491 0.4969 0.5686 0.6546 0.7523 0.7017 0.7173 0.7197 0.6335 0.5494 0.4925 0.7424 0.7121 0.7213 0.7687 0.7786 1.2534 0.8576 0.8096 0.4032 0.2786 0.2786 0.4976 0.2836 1.1302 1.7964 1.6866 0.7220 2.0185 0.1220 1.0261 0.5797 0.7401 2.7681 3.0022 0.1394 0.1559 1.6417 4.2374 1.8294 2.7434 4.8988 5.4217 1.9154 3.8353 4.8586 4.8389 0.2137 2.4926 0.2383 0.2420 0.2726 0.2807 0.2981 3.8887 4.3407 4.3835 4.4286 4.4368 0.3300 0.0620 0.2785 0.0966 0.0138 0.2899 0.8101 0.0774 2.1551 1.0914 0.2849 1.0578 0.3110 2.8090 1.6663 0.0732 1.0233 0.2115 0.2209 4.7342 0.1890 0.0236 0.1167 0.2931 1.1807 0.3647 3.5916 0.0946 2.1393 0.6011 2.5939 0.2545 0.5155 2.4534 1.6124 2.1023 5.9313 14.6610 9.0212 0.9793 2.4846 0.4729 0.8122 0.3080 12.5504 0.3940 2.5685 0.5781 4.1789 0.1439 2.1247 5.6123 4.8437 7.9262 7.6371 4.0551 3.5261 3.3577 6.0042 11.4938 5.8912 12.4356 10.9427 1.6584 26.7262 18.0439 28.9966 50.2459 23.6238 58.0498 22.5968 22.3888 21.6838 16.4586 69.3168 121.4471 59.1364 54.9830 14.6324 19.8885 54.5906 62.4430 19.3423 36.2550 33.6936 16.4299 94.9440 63.6823 73.4058 37.7534 4.1091 50.7666 5.2647 0.7231 21.1878 4.3605 3.2910 108.1912 5.6861 0.9638 4.0426 2.6884 0.00 -0.04 -0.03 0.03 -0.05 -0.04 0.04 0.01 -0.02 -0.03 -0.04 0.01 0.03 -0.09 -0.09 0.02 0.01 -0.06 -0.03 0.07 0.17 -0.02 0.12 -0.02 0.01 -0.06 0.01 0.12 0.27 0.22 -0.12 0.06 0.29 -0.05 0.03 -0.05 0.10 0.04 0.01 -0.03 0.04 -0.06 -0.15 -0.04 0.07 0.04 0.07 -0.03 0.04 -0.05 -0.14 0.02 -0.03 0.07 -0.05 -0.08 -0.04 0.03 -0.10 -0.20 0.08 0.04 -0.13 -0.04 0.04 0.08 -0.05 -0.03 0.00 0.03 0.01 0.04 0.06 0.03 0.17 -0.14 0.04 0.17 0.04 -0.04 -0.02 -0.01 -0.07 -0.04 0.01 0.02 -0.07 0.02 0.08 -0.08 0.03 -0.20 -0.16 0.04 -0.08 -0.03 -0.15 -0.11 0.43 0.02 0.01 -0.05 -0.01 0.06 -0.03 0.04 0.25 0.05 0.00 -0.04 -0.01 -0.01 -0.01 -0.09 -0.00 -0.02 -0.01 0.04 -0.03 -0.17 0.09 -0.01 -0.10 -0.12 0.01 -0.19 -0.00 0.00 -0.05 0.01 -0.04 0.01 -0.04 0.06 0.06 -0.02 0.12 -0.12 0.00 -0.04 0.00 0.01 0.05 0.20 0.08 -0.02 -0.00 -0.06 -0.05 0.05 0.02 -0.09 0.25 0.03 0.14 0.32 0.03 -0.04 -0.13 -0.03 -0.00 -0.03 0.06 -0.06 -0.13 0.11 -0.07 -0.15 -0.04 0.01 -0.21 -0.01 0.05 -0.07 0.02 -0.02 0.01 -0.04 0.14 0.08 -0.05 0.13 -0.18 0.04 -0.06 -0.05 -0.02 -0.02 0.16 0.03 0.00 0.03 -0.11 -0.05 0.03 -0.09 -0.09 0.27 0.09 0.05 0.20 -0.03 0.04 0.07 0.01 -0.13 0.11 -0.09 0.09 -0.31 -0.10 -0.06 0.03 -0.07 0.09 -0.06 0.08 0.04 0.15 -0.04 0.08 -0.15 0.07 -0.11 0.22 0.09 -0.05 -0.03 -0.05 -0.01 -0.25 -0.03 0.11 -0.19 -0.07 -0.08 0.06 0.03 -0.12 0.22 -0.04 0.04 0.11 -0.08 -0.03 0.02 -0.04 -0.07 0.05 0.04 -0.07 0.02 -0.09 -0.12 -0.06 -0.03 -0.00 -0.10 0.04 0.12 -0.07 -0.01 -0.20 -0.14 -0.07 -0.03 -0.05 -0.07 0.02 0.06 -0.02 -0.10 0.01 -0.05 -0.09 -0.14 -0.07 0.06 -0.08 0.12 -0.08 0.07 0.03 0.02 0.11 0.05 -0.10 0.06 0.22 0.06 0.07 0.02 -0.01 0.12 -0.03 0.16 -0.11 0.05 0.05 0.10 -0.06 0.12 -0.14 -0.09 0.02 0.03 0.07 0.31 0.03 -0.01 -0.00 0.15 -0.02 -0.03 0.02 -0.03 0.08 -0.16 -0.09 0.06 -0.02 -0.09 0.15 0.04 0.01 0.01 0.03 -0.02 -0.07 -0.11 0.05 0.05 0.04 -0.02 -0.09 -0.09 0.08 -0.13 -0.18 -0.13 0.02 -0.21 0.13 0.03 -0.08 0.05 0.03 -0.05 0.08 0.04 0.03 0.06 -0.11 -0.08 0.16 0.03 -0.13 -0.07 -0.01 -0.13 0.02 0.06 0.06 -0.01 0.11 0.00 -0.16 0.01 -0.06 0.00 -0.03 -0.19 -0.01 0.10 0.06 0.08 0.08 -0.04 0.06 0.09 0.00 -0.05 0.13 0.10 -0.03 -0.00 0.06 -0.02 0.01 0.07 -0.03 -0.02 0.04 0.02 -0.04 -0.01 0.17 0.06 0.18 -0.21 0.08 0.20 -0.04 -0.09 0.15 0.01 -0.06 0.00 -0.13 -0.03 -0.01 -0.11 -0.07 0.23 0.08 -0.15 0.09 0.01 0.13 0.08 0.15 0.09 -0.19 -0.10 0.06 -0.29 0.02 0.12 0.01 0.08 -0.15 -0.02 0.12 -0.01 0.22 0.03 -0.01 0.02 0.15 -0.12 0.28 0.07 -0.02 -0.03 0.04 -0.02 0.02 0.05 -0.08 0.03 -0.00 0.08 0.00 0.13 0.11 0.11 -0.09 -0.02 -0.07 -0.10 0.13 -0.12 0.10 0.11 -0.13 -0.14 -0.06 -0.07 0.09 0.01 0.17 -0.05 0.01 0.09 -0.08 -0.19 -0.04 -0.07 0.04 0.04 0.02 0.01 0.02 -0.10 -0.00 0.15 0.09 0.01 -0.06 0.08 -0.02 -0.00 -0.07 0.07 -0.09 -0.10 -0.04 -0.18 -0.01 -0.06 0.20 -0.19 -0.05 -0.13 0.00 0.02 -0.15 -0.15 0.07 -0.20 0.05 0.03 -0.01 0.02 -0.05 0.14 0.05 0.03 -0.00 0.10 0.11 -0.11 -0.01 -0.07 -0.09 -0.05 -0.04 -0.17 0.15 0.02 0.06 0.05 -0.03 -0.01 -0.03 -0.02 0.05 -0.25 0.17 0.06 -0.03 0.12 0.18 -0.07 0.04 0.03 -0.10 0.02 0.17 -0.03 0.03 0.08 -0.00 -0.02 -0.04 -0.04 0.16 -0.00 0.17 -0.03 -0.08 -0.01 0.01 0.09 0.13 -0.11 0.03 0.37 -0.11 0.18 0.03 -0.07 0.08 0.01 0.05 0.06 -0.08 0.05 -0.02 -0.03 0.12 -0.09 0.09 0.06 -0.01 0.06 0.03 0.01 -0.02 0.03 -0.14 0.11 0.06 -0.08 -0.05 0.01 -0.08 -0.11 0.08 -0.09 0.03 -0.07 -0.06 -0.02 -0.08 0.00 -0.02 0.06 0.13 -0.09 -0.05 0.04 -0.19 -0.05 -0.16 0.16 -0.11 -0.13 -0.09 -0.09 -0.01 -0.05 -0.04 0.09 -0.03 0.13 -0.02 0.02 -0.07 -0.11 -0.03 -0.25 -0.15 0.04 -0.02 0.09 -0.04 0.02 -0.13 -0.04 0.02 0.09 -0.10 0.19 0.01 0.24 -0.02 -0.01 -0.02 -0.13 0.08 -0.03 0.08 -0.01 0.01 -0.12 0.12 -0.01 0.08 -0.04 -0.02 0.08 -0.01 -0.10 0.05 -0.07 0.01 0.02 -0.06 -0.03 -0.07 0.01 -0.16 -0.08 -0.06 0.07 0.15 -0.05 -0.08 0.08 -0.04 0.03 0.09 -0.01 0.03 -0.12 0.05 0.12 -0.12 0.07 0.13 0.28 -0.18 -0.14 -0.02 -0.08 0.15 -0.15 0.01 0.01 -0.16 0.03 0.10 -0.02 -0.07 0.13 -0.07 0.12 0.20 -0.21 0.10 0.02 0.15 0.03 0.06 0.05 0.00 -0.04 0.05 -0.05 0.06 0.13 0.07 0.00 0.22 0.00 -0.14 -0.06 -0.02 -0.08 -0.05 0.08 -0.09 0.01 0.04 -0.10 -0.07 -0.06 -0.14 -0.08 -0.03 -0.15 -0.06 -0.14 -0.11 -0.00 0.01 -0.08 0.12 -0.15 0.21 -0.18 -0.02 -0.00 -0.08 0.02 0.07 0.11 -0.07 -0.05 0.12 0.04 0.04 0.12 -0.10 0.05 0.09 -0.02 -0.04 0.17 0.09 -0.08 0.12 0.00 0.03 0.09 -0.02 0.04 0.12 0.02 -0.10 -0.07 -0.04 0.10 0.19 0.01 -0.02 0.04 0.07 -0.04 -0.16 -0.05 -0.03 0.10 -0.05 -0.09 -0.15 0.03 -0.19 -0.22 0.10 -0.02 -0.11 -0.00 -0.08 -0.10 -0.01 -0.05 -0.09 0.07 -0.07 0.02 -0.13 -0.07 0.03 0.19 -0.13 -0.22 -0.01 0.21 -0.05 -0.05 0.04 -0.07 -0.05 0.12 -0.04 0.01 0.27 0.02 -0.03 0.17 -0.00 -0.03 -0.08 -0.02 0.10 -0.04 0.08 -0.01 -0.04 0.11 0.08 0.03 -0.05 -0.01 -0.02 -0.13 -0.00 -0.07 -0.09 -0.12 -0.02 -0.05 0.17 -0.06 0.13 -0.04 -0.04 -0.18 -0.02 -0.15 0.21 -0.01 0.07 0.01 -0.03 -0.01 -0.07 0.01 0.10 -0.08 0.03 0.03 -0.06 -0.07 -0.14 0.02 0.11 0.02 -0.25 0.08 0.12 -0.01 -0.03 0.06 -0.08 -0.03 0.12 0.12 0.05 0.31 0.08 0.13 -0.04 -0.00 0.13 -0.08 0.01 0.05 -0.01 -0.03 -0.09 -0.04 -0.01 0.01 -0.06 -0.02 0.04 -0.08 0.02 0.07 -0.03 -0.05 -0.02 0.20 0.00 -0.15 0.04 -0.00 -0.06 -0.12 0.06 0.11 0.01 -0.23 0.07 -0.06 -0.01 -0.06 -0.03 -0.03 0.00 -0.08 0.03 0.01 0.10 0.10 -0.01 -0.23 0.05 0.06 -0.03 0.11 -0.08 0.06 0.04 -0.05 -0.00 -0.09 0.02 -0.06 0.08 -0.02 -0.14 0.29 0.10 0.09 0.13 0.15 -0.11 0.04 -0.03 0.00 -0.08 -0.02 -0.03 0.02 0.04 0.35 -0.14 -0.06 -0.10 -0.06 0.05 0.13 -0.06 -0.02 -0.15 -0.00 -0.01 0.04 -0.02 0.09 0.26 -0.14 -0.11 0.12 0.10 -0.05 -0.04 0.12 -0.12 -0.09 -0.04 -0.02 -0.05 0.09 -0.07 0.12 0.33 -0.06 -0.17 0.06 0.08 -0.06 -0.07 0.03 -0.11 -0.05 0.05 -0.04 -0.04 0.05 -0.04 0.08 -0.06 -0.12 -0.18 -0.10 -0.02 0.01 -0.02 -0.00 -0.02 -0.11 -0.01 0.11 -0.13 -0.02 0.14 0.17 -0.03 -0.12 0.02 -0.01 -0.03 0.09 -0.00 -0.03 0.04 -0.08 -0.11 0.03 -0.19 -0.12 0.01 0.16 -0.05 -0.05 0.10 0.05 0.01 0.09 -0.05 0.01 0.09 -0.02 0.00 0.07 0.01 0.06 0.13 0.15 0.09 -0.00 0.03 -0.09 -0.20 -0.12 0.22 0.12 -0.08 0.09 -0.06 -0.06 0.03 0.08 -0.14 -0.05 0.12 0.11 0.01 -0.00 -0.16 0.05 0.02 0.22 -0.15 0.00 -0.13 -0.03 0.05 -0.24 -0.03 -0.10 -0.06 -0.04 0.00 -0.02 0.05 0.12 0.10 0.09 -0.09 -0.00 0.04 -0.13 0.07 -0.13 0.10 0.05 -0.11 0.03 0.17 -0.04 0.03 0.09 0.03 -0.01 -0.00 -0.06 -0.02 0.30 -0.07 -0.02 0.08 -0.13 -0.04 -0.13 -0.03 -0.05 -0.09 0.15 0.06 -0.10 -0.07 -0.20 -0.06 0.04 -0.04 -0.25 0.03 -0.02 -0.05 0.02 0.08 0.06 0.02 0.07 0.07 0.08 -0.15 -0.07 -0.08 0.10 -0.20 0.01 -0.01 0.07 0.06 0.08 -0.01 0.01 -0.03 0.01 0.04 0.04 0.17 -0.04 -0.14 0.01 0.01 -0.03 -0.06 -0.05 0.15 0.06 -0.03 -0.07 -0.10 -0.08 0.10 -0.02 -0.09 -0.18 0.18 0.06 -0.01 0.11 -0.01 -0.08 0.07 -0.01 0.03 0.06 0.05 -0.08 0.02 0.12 -0.09 0.03 -0.06 0.04 0.16 0.04 -0.04 -0.01 -0.03 0.03 0.04 -0.02 -0.10 -0.06 -0.04 -0.02 0.07 -0.04 0.02 -0.06 -0.03 0.06 0.02 -0.04 -0.03 0.09 -0.08 0.10 -0.07 -0.04 0.19 -0.15 -0.07 0.13 0.12 0.08 0.07 -0.10 -0.04 -0.04 -0.13 -0.01 -0.05 -0.01 -0.03 -0.04 0.02 0.09 0.23 -0.21 0.16 -0.15 -0.10 -0.02 -0.13 0.03 0.01 -0.06 -0.08 -0.07 -0.01 -0.07 0.07 -0.30 -0.05 0.07 0.09 0.04 0.04 -0.05 0.09 0.00 0.02 0.13 -0.10 0.05 -0.10 0.16 0.32 0.08 0.06 -0.04 -0.11 -0.13 0.05 -0.21 0.21 0.01 0.06 0.17 0.11 -0.09 -0.07 -0.04 0.06 -0.03 -0.05 0.06 0.07 0.11 -0.07 0.09 -0.05 0.10 0.05 0.09 -0.01 -0.05 0.35 -0.13 0.01 -0.08 0.13 -0.10 -0.14 -0.05 -0.06 -0.06 0.04 0.04 -0.04 0.05 -0.01 -0.04 -0.13 0.07 -0.14 -0.05 -0.05 0.04 -0.03 -0.01 -0.04 0.05 -0.03 0.05 -0.03 -0.08 0.11 -0.21 0.01 0.15 0.08 0.09 0.00 0.01 -0.07 -0.03 -0.04 -0.16 -0.15 0.03 0.04 -0.10 0.04 -0.06 0.19 -0.02 0.12 0.04 0.02 -0.05 -0.00 -0.03 0.01 0.03 -0.01 -0.05 0.22 0.11 0.04 -0.14 0.12 0.04 -0.06 0.03 0.04 0.07 -0.09 0.05 0.01 -0.05 0.16 0.05 0.13 -0.14 -0.30 0.02 0.04 -0.01 -0.02 0.04 -0.12 0.07 -0.14 -0.03 0.15 -0.22 -0.01 -0.03 -0.07 0.16 -0.11 -0.06 -0.04 -0.06 0.08 0.01 0.03 -0.08 0.04 -0.13 0.21 -0.01 0.00 -0.05 -0.14 0.11 0.01 0.04 -0.27 0.05 -0.08 -0.03 -0.03 -0.03 0.10 -0.10 -0.03 0.04 -0.02 -0.05 -0.08 0.03 -0.09 0.05 -0.11 -0.04 0.05 -0.06 0.11 0.05 0.09 0.00 0.05 -0.07 -0.21 -0.09 0.15 0.11 0.12 -0.02 -0.00 -0.01 -0.04 0.04 -0.03 -0.16 -0.08 -0.00 0.02 -0.24 0.03 -0.05 0.18 -0.16 0.19 0.10 0.07 0.02 0.09 -0.02 0.03 0.08 0.03 0.02 -0.05 -0.14 0.05 0.28 -0.03 -0.08 0.06 0.04 0.04 -0.04 0.00 0.02 -0.03 0.02 -0.07 -0.08 0.15 0.13 0.12 -0.04 -0.04 -0.03 0.04 -0.04 -0.07 0.10 -0.14 0.04 -0.25 0.04 0.02 0.05 -0.07 0.22 -0.19 -0.05 0.03 -0.06 -0.04 0.04 0.09 0.03 -0.02 0.01 -0.11 -0.01 0.05 0.17 0.09 -0.04 -0.11 -0.05 0.30 -0.08 0.08 -0.07 0.01 0.01 -0.01 -0.03 0.09 0.09 0.10 0.04 -0.17 0.01 0.03 0.04 -0.06 -0.08 -0.05 -0.10 0.11 -0.02 -0.02 0.01 -0.03 0.03 -0.18 -0.25 0.08 0.01 0.07 0.03 0.07 -0.09 0.04 0.11 -0.01 -0.01 0.13 -0.09 0.00 0.14 -0.16 -0.05 -0.00 -0.06 -0.04 -0.08 0.04 0.08 -0.01 -0.05 -0.02 -0.03 -0.03 -0.05 -0.25 -0.16 0.07 0.10 0.04 -0.08 -0.08 0.12 -0.00 0.02 0.03 0.03 -0.06 0.18 0.01 -0.12 0.17 0.01 -0.13 0.15 0.02 0.06 0.10 0.16 -0.01 0.22 -0.33 -0.01 0.01 0.07 0.07 -0.03 0.03 0.12 -0.07 0.00 0.05 0.05 -0.03 -0.03 -0.00 0.02 -0.05 -0.08 -0.05 0.02 -0.01 0.00 0.03 0.02 0.04 0.02 0.14 -0.01 -0.00 0.05 0.05 0.05 -0.02 0.05 -0.04 -0.05 -0.07 -0.03 -0.08 0.08 0.16 0.09 -0.16 -0.16 0.01 0.03 -0.07 0.01 -0.10 0.04 -0.06 -0.01 -0.33 0.11 0.12 -0.15 -0.06 -0.09 0.10 0.01 -0.07 -0.00 -0.06 0.01 -0.10 0.07 0.05 0.07 -0.01 -0.12 0.45 0.18 0.23 0.03 -0.08 0.02 -0.05 -0.06 0.00 -0.11 -0.04 0.11 -0.01 0.16 -0.17 0.07 -0.15 0.03 -0.00 -0.04 -0.03 0.01 0.00 -0.03 0.04 -0.12 0.04 0.03 -0.15 -0.01 -0.01 0.13 0.11 -0.04 -0.04 -0.12 0.21 0.03 -0.01 -0.00 0.20 -0.01 0.01 -0.05 0.01 -0.01 0.10 -0.01 -0.01 0.02 0.03 -0.08 -0.03 -0.01 -0.05 -0.09 0.05 0.00 -0.05 -0.07 -0.11 -0.03 -0.01 -0.01 -0.01 -0.00 -0.06 -0.07 -0.15 -0.09 0.12 0.03 0.03 0.03 0.02 0.09 -0.13 0.04 -0.19 -0.26 0.19 -0.03 0.09 -0.09 0.10 0.02 -0.04 0.03 -0.12 0.06 -0.18 0.10 0.03 0.05 0.09 -0.12 0.04 -0.04 0.07 -0.07 0.00 -0.06 -0.07 0.04 0.01 0.43 -0.01 0.19 -0.07 0.09 -0.08 0.01 -0.04 0.01 0.02 -0.00 -0.04 0.03 0.03 0.04 0.02 0.14 -0.12 -0.00 -0.14 0.08 0.07 0.08 0.09 0.00 0.06 0.07 0.03 0.04 0.01 0.21 0.11 -0.09 -0.00 -0.04 -0.01 0.08 -0.05 0.07 -0.21 -0.10 -0.02 -0.03 0.12 -0.07 0.18 -0.22 -0.09 -0.04 0.07 -0.05 0.02 -0.04 0.01 -0.02 0.03 0.01 0.01 -0.20 0.09 -0.01 0.02 0.03 0.06 0.02 -0.01 0.04 0.21 -0.04 -0.02 0.00 0.04 0.04 -0.11 0.04 -0.04 -0.02 -0.06 -0.05 0.17 -0.07 -0.03 -0.05 0.12 0.03 0.10 -0.13 0.06 -0.02 0.01 0.00 0.12 -0.10 -0.09 -0.16 0.09 0.33 0.25 -0.06 -0.03 0.05 0.05 -0.00 0.00 0.06 0.11 -0.03 0.02 -0.12 0.13 0.15 -0.14 -0.11 -0.01 -0.00 -0.02 0.05 -0.01 -0.00 -0.02 0.05 0.02 0.00 -0.06 0.15 -0.13 0.07 -0.11 0.04 -0.03 -0.09 -0.12 -0.02 -0.06 -0.01 0.03 -0.23 0.04 -0.02 -0.24 -0.06 -0.10 0.15 0.10 -0.05 -0.01 -0.06 -0.03 -0.14 0.21 0.01 0.26 -0.02 0.09 0.11 -0.11 -0.03 -0.03 0.05 -0.01 -0.03 0.06 -0.01 -0.01 0.02 0.10 0.37 -0.03 0.02 -0.04 -0.03 -0.12 -0.03 0.00 -0.12 -0.06 -0.02 -0.01 -0.00 -0.02 0.05 -0.04 -0.10 0.08 0.04 -0.01 -0.14 0.05 -0.19 -0.01 -0.31 0.32 -0.03 -0.04 -0.02 -0.03 0.04 0.20 0.01 0.08 0.06 -0.09 -0.04 0.03 -0.08 -0.05 -0.01 0.09 0.05 -0.01 0.00 0.01 -0.05 0.10 -0.05 -0.03 -0.05 0.02 -0.09 0.17 0.01 0.09 0.00 0.03 -0.02 0.05 -0.00 0.06 0.04 0.04 -0.01 -0.02 -0.06 0.02 0.04 0.02 -0.05 -0.06 0.00 -0.04 0.01 0.03 0.01 -0.03 0.11 -0.02 0.11 -0.24 -0.11 -0.02 0.10 0.03 0.09 0.00 0.09 0.01 -0.26 0.28 -0.08 -0.07 -0.10 -0.04 0.08 0.06 0.04 -0.22 -0.01 -0.08 -0.10 -0.02 -0.08 0.03 0.02 0.04 0.02 0.04 -0.04 0.02 -0.01 -0.08 0.03 0.01 0.01 0.25 -0.01 0.03 0.01 0.00 -0.02 -0.05 -0.12 0.04 0.07 0.05 -0.04 0.06 -0.09 -0.07 0.08 -0.00 0.04 -0.06 0.02 0.04 -0.05 0.04 -0.00 0.11 0.00 0.01 0.03 0.01 -0.08 -0.13 -0.03 0.03 0.01 0.06 0.10 0.03 -0.08 0.14 -0.05 0.00 -0.22 -0.10 -0.16 0.01 -0.08 0.07 -0.00 -0.05 -0.03 -0.03 0.01 -0.02 0.04 0.02 0.01 0.05 0.23 -0.19 -0.07 -0.18 0.10 0.10 0.04 0.07 -0.05 0.03 0.07 0.06 -0.06 0.03 0.11 0.23 -0.03 -0.05 -0.12 -0.05 0.03 0.08 0.04 -0.10 0.18 -0.16 -0.02 0.42 -0.07 -0.07 0.18 0.10 0.17 -0.24 -0.01 0.06 0.04 0.01 0.02 0.00 0.07 0.23 0.13 0.13 0.01 -0.00 0.06 0.16 -0.03 0.02 -0.03 0.04 0.03 -0.10 -0.03 -0.08 0.08 -0.01 -0.07 -0.05 -0.02 -0.16 0.23 0.14 0.17 -0.18 0.05 -0.08 0.04 0.02 -0.07 0.12 0.02 -0.03 -0.02 -0.04 0.05 -0.06 0.10 -0.03 -0.20 0.05 0.08 -0.03 0.01 0.15 0.03 -0.04 -0.18 -0.00 0.02 0.07 -0.03 -0.23 -0.17 -0.09 0.18 0.03 -0.02 -0.03 -0.05 0.04 0.06 0.02 0.17 0.13 0.01 -0.01 -0.08 -0.02 -0.02 -0.21 0.05 -0.05 -0.06 -0.05 -0.00 -0.04 0.01 -0.03 0.05 -0.02 -0.20 -0.13 0.14 0.11 0.04 0.02 -0.08 0.01 -0.12 -0.17 -0.12 0.13 -0.01 -0.06 0.06 0.02 -0.05 0.02 0.24 -0.15 -0.06 0.06 0.01 -0.04 -0.04 -0.02 -0.07 -0.03 -0.20 -0.01 0.00 -0.04 0.02 -0.20 -0.11 -0.15 0.04 0.00 -0.05 0.04 0.09 -0.09 -0.00 0.07 0.04 -0.00 0.01 -0.04 0.10 0.05 -0.01 0.08 -0.10 0.08 -0.01 0.02 -0.07 0.04 -0.00 -0.05 0.02 -0.06 -0.00 0.19 -0.14 -0.16 -0.22 0.20 0.27 -0.08 -0.02 0.10 -0.05 0.01 0.06 -0.06 0.11 -0.04 -0.24 -0.22 -0.22 0.03 0.16 0.14 0.04 0.01 0.13 0.03 -0.01 -0.01 -0.06 -0.07 -0.03 -0.03 -0.00 0.09 0.15 0.12 -0.04 0.02 0.01 0.09 0.01 0.03 -0.02 0.01 -0.10 0.06 0.25 -0.07 -0.13 -0.13 0.03 0.11 0.03 -0.02 -0.06 0.10 -0.10 0.10 0.01 0.02 -0.02 0.03 -0.08 -0.02 -0.17 0.15 -0.01 0.03 -0.13 -0.06 0.12 0.09 -0.02 0.13 -0.22 0.08 0.11 0.02 0.07 0.26 0.12 -0.00 0.05 -0.08 -0.01 0.05 0.13 -0.02 -0.06 0.01 -0.00 0.08 0.06 0.07 -0.17 -0.10 -0.14 0.07 -0.09 0.19 0.03 0.08 0.02 -0.00 -0.13 -0.05 0.00 -0.03 -0.08 -0.05 0.12 0.06 -0.06 0.07 0.06 -0.07 -0.02 -0.00 -0.03 0.05 0.04 -0.12 0.11 -0.08 -0.09 0.02 0.05 0.07 0.01 0.13 -0.04 -0.10 -0.06 -0.04 0.03 -0.10 0.02 0.03 0.04 0.03 -0.15 0.02 -0.15 -0.26 0.13 -0.12 0.03 0.03 0.06 0.05 0.03 -0.06 0.28 0.01 0.01 -0.04 -0.08 -0.05 -0.12 -0.10 0.07 0.05 0.15 0.05 0.05 -0.00 0.09 -0.29 0.09 0.03 -0.02 -0.07 -0.19 0.06 -0.04 -0.06 -0.14 0.04 0.03 -0.03 0.10 -0.07 0.16 -0.12 0.22 -0.15 -0.03 -0.14 -0.10 0.04 -0.06 -0.15 0.06 0.04 0.08 -0.01 -0.11 -0.06 0.04 -0.04 -0.07 -0.03 0.09 -0.09 0.12 0.04 0.16 -0.15 0.04 -0.00 -0.10 -0.10 -0.11 0.14 0.01 -0.05 -0.06 0.05 -0.17 -0.03 0.05 0.08 0.01 -0.04 -0.01 -0.03 -0.04 -0.02 0.08 -0.10 0.06 -0.04 -0.03 -0.03 -0.04 -0.04 -0.00 -0.03 -0.01 0.03 0.08 0.07 -0.05 -0.06 0.05 0.04 -0.02 -0.04 0.36 -0.19 -0.01 -0.04 0.13 -0.05 0.06 -0.03 0.08 0.05 0.11 0.01 0.28 -0.03 0.01 -0.13 0.00 0.25 0.08 -0.04 -0.03 -0.06 -0.11 0.01 0.16 -0.18 -0.02 0.02 -0.14 0.04 -0.08 -0.10 -0.13 -0.04 0.04 -0.06 -0.03 0.06 -0.02 0.01 -0.11 -0.15 0.07 -0.10 -0.14 0.11 -0.15 0.21 0.24 0.12 -0.02 -0.12 -0.06 0.07 -0.02 -0.06 -0.10 0.03 0.07 -0.09 -0.09 -0.07 0.21 0.00 0.09 0.01 0.04 -0.10 0.03 -0.00 0.01 -0.07 -0.01 0.15 0.01 0.11 -0.00 -0.09 -0.00 0.11 0.15 -0.03 -0.09 0.02 -0.04 0.06 -0.07 -0.02 0.23 0.07 -0.00 -0.01 -0.05 -0.17 -0.15 -0.02 0.02 0.01 -0.02 0.01 -0.05 -0.04 0.04 0.00 0.05 0.02 -0.01 0.01 -0.18 0.10 -0.10 -0.10 0.10 0.02 0.04 0.02 -0.05 0.03 -0.00 0.02 -0.02 -0.01 0.20 -0.06 -0.15 -0.06 0.18 0.14 -0.06 -0.10 -0.20 -0.02 0.01 -0.11 -0.01 -0.17 -0.03 0.01 0.17 0.07 -0.26 0.10 0.12 -0.02 -0.09 0.02 -0.06 0.00 -0.03 0.21 0.07 0.18 -0.12 0.04 -0.02 -0.06 -0.08 -0.11 -0.03 0.12 -0.06 -0.02 0.07 0.12 0.05 -0.04 -0.12 -0.02 -0.03 -0.06 0.00 -0.14 0.23 0.19 0.08 -0.10 0.07 -0.04 -0.04 0.02 -0.05 0.04 -0.04 -0.11 -0.03 0.00 0.04 -0.02 -0.16 -0.03 0.09 -0.03 0.02 -0.11 0.04 -0.03 -0.12 -0.18 0.03 0.01 0.10 0.18 0.16 -0.07 -0.07 -0.12 -0.03 0.07 -0.05 0.04 0.06 -0.01 0.18 0.14 -0.05 -0.07 -0.14 0.07 0.03 -0.12 0.02 0.04 0.01 0.05 -0.07 0.01 0.05 0.02 -0.06 0.03 0.23 -0.08 -0.13 -0.13 0.13 0.17 -0.02 -0.01 -0.12 0.26 0.03 0.07 -0.04 0.10 -0.04 -0.04 -0.15 -0.09 0.18 -0.15 -0.03 -0.03 0.01 0.05 0.06 0.02 -0.10 0.04 0.21 0.02 0.00 0.03 0.02 0.01 0.24 0.12 0.17 0.01 -0.00 -0.00 0.06 0.02 -0.01 0.12 -0.14 0.13 0.05 -0.05 -0.11 -0.21 0.04 -0.08 0.07 0.06 -0.05 0.05 -0.06 -0.02 0.10 0.21 -0.00 0.02 0.10 0.17 -0.03 -0.21 -0.11 0.13 0.08 0.04 -0.06 -0.04 0.01 0.01 0.01 -0.08 -0.01 -0.05 0.12 -0.06 -0.03 -0.08 -0.12 -0.13 0.04 -0.11 0.07 -0.02 -0.02 0.08 -0.13 -0.13 0.02 0.07 0.08 -0.04 0.06 -0.16 0.09 -0.03 -0.05 -0.02 0.03 -0.01 -0.12 0.02 -0.16 0.02 -0.14 0.02 0.10 -0.12 0.07 0.07 0.10 0.06 0.04 -0.11 0.33 -0.26 0.13 0.02 0.09 0.06 -0.04 0.02 -0.02 -0.09 0.01 -0.05 -0.14 0.00 -0.04 -0.02 0.08 -0.05 0.06 -0.12 0.01 -0.03 0.09 -0.13 -0.19 -0.09 -0.03 0.24 0.03 0.02 -0.02 -0.00 -0.09 -0.08 -0.00 -0.02 -0.03 -0.00 0.06 -0.04 0.04 -0.08 0.10 -0.06 -0.09 0.18 0.02 -0.04 -0.07 0.14 -0.00 0.06 0.05 -0.08 0.13 0.03 -0.03 0.27 0.12 0.02 0.05 -0.01 -0.00 0.02 0.05 0.06 -0.01 0.02 -0.04 0.06 -0.01 -0.05 0.00 -0.07 0.14 -0.16 -0.14 0.03 -0.02 -0.12 -0.12 -0.07 0.06 0.41 -0.28 0.18 -0.03 0.11 -0.17 0.03 0.01 -0.03 -0.02 -0.00 0.06 0.05 0.02 -0.00 0.01 -0.02 0.02 0.11 0.07 0.01 -0.03 -0.01 -0.04 -0.13 0.11 -0.16 -0.02 0.17 0.07 0.08 -0.03 -0.07 -0.06 -0.11 0.03 0.05 -0.05 -0.05 0.07 0.02 -0.02 0.21 0.09 0.03 0.06 -0.02 0.12 -0.22 -0.11 -0.15 0.12 0.08 0.01 -0.04 0.08 -0.04 0.01 0.10 -0.14 0.03 0.03 -0.12 0.04 -0.07 0.11 -0.01 0.02 -0.00 0.04 0.02 0.12 0.07 0.00 0.11 -0.05 0.12 -0.02 0.00 0.11 0.13 0.39 -0.17 -0.30 -0.08 -0.10 0.06 -0.02 -0.01 0.00 -0.20 0.08 -0.02 0.05 -0.20 -0.06 -0.03 0.01 0.08 -0.05 -0.03 -0.04 -0.05 -0.00 0.05 -0.09 -0.05 0.04 -0.03 0.04 -0.09 -0.05 0.22 -0.20 -0.04 -0.03 0.05 0.03 0.01 -0.06 -0.00 0.00 0.06 0.01 -0.08 0.03 -0.11 0.04 0.11 0.03 0.03 -0.08 0.01 0.04 0.01 0.09 0.04 0.08 -0.02 0.23 0.12 -0.09 -0.02 -0.03 0.07 -0.03 -0.07 0.16 0.14 -0.08 0.05 0.00 -0.13 0.28 -0.09 0.10 -0.24 0.16 -0.05 0.01 -0.08 -0.12 -0.11 -0.16 0.01 0.04 -0.01 0.04 -0.16 -0.10 -0.02 0.14 0.11 0.14 -0.11 -0.01 -0.17 -0.03 0.01 0.01 0.03 0.01 0.03 0.00 0.04 0.09 0.03 0.03 -0.04 -0.05 -0.02 -0.01 0.11 0.16 -0.03 -0.06 -0.09 -0.02 0.13 -0.08 0.15 -0.17 0.24 0.03 -0.03 -0.01 -0.13 -0.05 -0.07 0.05 0.00 -0.05 -0.01 -0.09 -0.06 0.04 -0.10 -0.03 -0.03 -0.06 -0.08 0.06 -0.04 -0.02 0.12 0.11 0.05 -0.03 -0.05 0.11 0.08 0.14 -0.01 -0.09 -0.18 -0.09 0.08 -0.08 -0.18 -0.11 -0.07 -0.12 0.03 0.06 -0.18 -0.17 -0.08 -0.05 -0.03 -0.00 0.02 0.00 -0.01 0.01 0.05 0.07 -0.02 -0.07 -0.01 0.13 -0.03 -0.10 0.10 0.06 -0.20 -0.11 -0.15 0.40 0.03 0.16 0.05 -0.03 -0.04 -0.02 -0.09 0.13 -0.05 -0.05 0.08 0.04 0.03 -0.08 -0.07 0.01 0.01 0.04 -0.02 -0.04 -0.15 -0.06 0.00 0.02 -0.05 -0.08 -0.09 -0.04 0.06 -0.06 0.02 0.06 -0.01 0.01 -0.02 -0.07 -0.01 0.12 0.03 -0.01 -0.04 0.04 0.04 0.03 0.09 0.09 0.06 0.00 0.04 -0.06 -0.02 0.05 -0.03 0.13 0.12 -0.04 0.02 0.03 -0.02 -0.03 -0.07 0.04 -0.04 -0.02 0.03 0.01 -0.05 -0.03 0.03 -0.01 0.01 -0.13 0.07 0.10 -0.16 -0.04 0.03 -0.05 -0.05 0.05 -0.12 0.03 -0.09 0.28 -0.06 0.49 -0.01 -0.05 -0.07 -0.19 0.09 0.05 -0.12 0.12 -0.03 0.02 -0.03 0.01 -0.11 -0.18 0.15 -0.01 0.03 0.03 0.07 -0.21 -0.19 0.17 -0.15 0.16 -0.01 0.06 0.04 -0.09 0.09 -0.03 -0.04 -0.04 -0.02 -0.12 -0.12 0.03 -0.01 0.05 0.01 0.02 -0.03 -0.00 0.07 0.14 -0.13 0.02 0.09 0.12 -0.09 0.05 0.05 -0.08 -0.04 0.01 0.17 0.02 0.06 0.07 -0.05 -0.02 0.11 -0.02 0.06 -0.08 -0.07 -0.12 -0.14 -0.24 -0.18 0.04 -0.02 -0.02 -0.07 0.08 -0.05 0.05 0.02 0.00 0.07 0.08 -0.06 -0.02 0.06 -0.03 -0.09 0.01 0.03 0.00 0.03 -0.04 -0.02 0.15 0.01 0.10 -0.19 -0.07 0.02 0.08 0.07 -0.06 -0.01 -0.05 -0.01 0.19 -0.13 0.12 -0.20 0.30 0.01 0.10 0.13 0.18 -0.06 0.04 0.16 -0.08 -0.04 -0.08 -0.06 0.02 0.08 -0.10 -0.11 -0.16 0.05 -0.02 0.13 -0.05 0.02 0.05 0.09 0.06 0.01 -0.00 -0.06 -0.00 0.18 -0.00 -0.08 -0.09 -0.11 0.02 -0.25 0.06 -0.20 -0.05 0.16 0.02 -0.04 0.02 0.15 -0.02 0.11 0.00 0.01 0.03 0.05 0.02 -0.02 -0.07 -0.09 -0.00 0.04 0.07 -0.06 -0.12 -0.03 0.18 0.01 0.05 -0.01 -0.21 0.17 0.02 0.04 -0.02 -0.05 -0.01 0.04 0.01 0.02 -0.05 0.03 0.01 0.01 -0.02 -0.03 0.07 -0.04 0.01 0.04 -0.02 -0.02 0.03 -0.00 -0.06 0.02 -0.02 -0.01 0.02 -0.03 -0.09 0.04 0.08 0.09 0.08 0.03 -0.04 -0.11 -0.22 -0.27 0.13 -0.16 0.01 0.10 0.16 -0.08 -0.03 -0.02 -0.38 0.23 0.02 0.02 -0.07 -0.08 -0.09 -0.07 -0.06 0.27 0.16 0.06 -0.24 0.13 -0.03 0.29 -0.03 -0.04 0.11 -0.15 0.13 -0.02 -0.06 0.03 0.07 -0.17 -0.09 -0.10 -0.05 0.06 0.05 0.13 0.01 0.05 -0.02 -0.07 -0.07 0.04 0.01 -0.11 -0.10 -0.06 -0.03 0.09 -0.02 0.10 -0.09 -0.08 0.09 0.09 -0.02 -0.00 0.03 0.02 0.03 -0.04 -0.06 -0.01 -0.05 0.07 0.07 0.03 0.05 0.01 0.07 0.03 0.05 -0.05 0.08 -0.15 0.03 0.00 -0.17 -0.10 0.05 0.06 0.16 -0.06 0.18 0.04 -0.09 -0.05 0.06 0.08 -0.08 0.02 0.01 -0.04 0.21 -0.06 0.07 0.02 -0.06 -0.04 -0.04 -0.01 -0.09 -0.04 -0.00 0.08 -0.18 0.16 0.04 -0.16 0.30 -0.03 0.11 0.01 0.07 -0.13 -0.03 -0.00 -0.04 0.01 0.02 -0.00 0.02 -0.12 -0.09 -0.09 -0.08 0.05 0.00 -0.02 -0.06 -0.03 0.09 0.07 0.07 -0.06 -0.03 -0.01 -0.02 0.12 -0.03 0.05 0.08 0.04 0.08 0.14 0.07 0.30 -0.21 -0.08 -0.05 0.01 0.02 0.09 0.05 0.12 0.00 0.00 0.11 0.09 -0.02 -0.08 0.04 -0.03 -0.07 0.01 -0.00 -0.00 -0.03 0.02 -0.04 -0.06 0.02 0.04 -0.04 -0.01 -0.02 -0.02 -0.04 -0.02 0.03 0.06 -0.06 0.05 -0.05 0.00 -0.03 -0.01 -0.02 0.06 0.02 0.00 0.00 -0.16 0.11 -0.03 0.04 -0.02 -0.04 -0.02 -0.01 -0.03 0.05 -0.02 -0.08 -0.04 0.05 -0.05 0.01 -0.06 0.05 0.05 0.13 0.42 -0.46 0.38 0.06 0.05 0.15 0.02 -0.05 0.04 -0.00 0.04 -0.03 0.04 -0.03 0.06 -0.04 -0.05 -0.08 -0.07 0.06 -0.12 -0.08 0.01 -0.00 0.04 0.16 0.14 0.12 0.06 -0.01 -0.07 0.06 -0.01 0.03 -0.07 0.08 0.04 0.07 0.08 -0.00 0.04 0.08 0.18 -0.09 -0.03 0.13 -0.00 -0.06 -0.02 -0.06 0.03 0.07 -0.22 0.02 -0.18 0.15 0.14 -0.00 0.04 0.09 0.06 0.04 0.02 0.00 -0.04 -0.15 -0.07 0.05 0.03 -0.11 -0.00 -0.07 -0.08 -0.09 -0.09 -0.03 -0.12 0.07 0.04 -0.03 0.03 0.05 -0.02 -0.00 -0.05 0.03 -0.07 -0.11 0.29 -0.14 -0.02 0.03 0.01 0.03 -0.04 0.03 -0.00 -0.01 -0.04 -0.03 0.00 0.03 -0.02 -0.07 -0.09 0.05 0.03 0.18 0.26 -0.17 0.19 0.06 0.03 0.14 0.12 -0.34 -0.14 0.14 -0.12 -0.07 0.17 -0.02 0.04 -0.03 -0.03 -0.02 -0.06 -0.02 -0.22 -0.08 0.07 -0.08 -0.08 0.01 0.03 0.06 0.04 -0.00 -0.10 0.07 -0.03 0.08 -0.10 0.23 0.07 0.11 0.05 -0.10 -0.04 0.03 -0.16 0.12 -0.05 -0.05 -0.00 0.02 -0.06 -0.10 -0.07 -0.02 0.26 -0.03 0.05 -0.09 -0.03 -0.02 0.00 0.00 0.05 -0.01 0.03 0.07 0.10 -0.16 -0.11 0.05 0.03 0.09 -0.05 -0.02 -0.03 -0.20 0.01 0.01 0.06 -0.02 -0.00 0.06 0.04 -0.01 0.04 0.00 -0.02 -0.08 0.06 0.01 -0.08 0.08 -0.02 -0.05 0.02 0.06 -0.01 0.06 0.01 0.04 -0.01 0.10 -0.11 -0.07 0.08 -0.08 -0.01 0.02 0.13 0.20 -0.14 0.23 -0.13 0.03 -0.00 0.09 -0.08 0.43 0.21 0.17 0.04 -0.10 -0.00 -0.02 0.00 -0.03 0.03 -0.01 -0.11 -0.08 -0.09 0.01 -0.02 0.04 0.09 -0.00 -0.06 0.02 -0.05 0.07 -0.05 -0.08 0.02 -0.03 0.13 -0.05 0.13 0.08 -0.02 0.04 0.10 0.03 -0.02 0.00 -0.14 0.09 -0.04 -0.03 0.15 0.07 0.15 -0.07 0.30 -0.18 -0.04 0.06 0.04 -0.21 -0.00 0.16 -0.09 -0.05 -0.04 -0.03 0.12 0.02 0.07 -0.15 -0.07 0.17 0.05 0.15 0.10 0.01 0.14 0.01 -0.09 0.03 0.02 0.02 0.03 0.08 -0.02 -0.00 0.01 0.07 -0.08 -0.06 0.13 -0.05 -0.02 -0.02 0.00 -0.01 0.04 -0.01 -0.03 0.03 -0.02 0.04 -0.08 -0.02 -0.03 0.02 0.03 0.10 0.08 0.10 0.03 0.06 -0.12 0.00 -0.03 0.09 -0.17 0.51 0.12 -0.06 0.17 0.00 -0.03 -0.01 -0.05 0.03 -0.03 0.02 0.14 0.00 0.13 0.03 -0.02 0.03 -0.04 -0.01 0.06 -0.10 0.02 -0.09 -0.02 -0.01 -0.06 -0.03 -0.00 0.02 0.05 0.03 0.03 0.08 0.05 0.03 0.10 -0.11 -0.04 0.02 -0.02 -0.01 -0.13 -0.05 -0.05 0.03 0.23 -0.05 -0.04 -0.03 0.04 -0.11 -0.01 0.06 0.11 -0.00 0.01 -0.14 0.02 0.24 -0.17 0.08 0.08 0.03 -0.00 -0.01 -0.01 -0.15 -0.06 -0.01 -0.01 0.01 -0.13 0.09 -0.04 0.06 0.04 0.01 0.01 0.02 0.03 0.08 -0.00 -0.08 0.01 0.04 -0.03 0.06 0.02 -0.04 0.02 -0.12 0.05 -0.08 0.06 0.05 0.02 -0.03 -0.09 0.09 -0.04 0.07 0.13 -0.24 0.15 -0.06 0.03 -0.18 -0.05 0.35 0.12 -0.44 0.23 0.06 0.01 -0.00 -0.01 -0.08 0.08 0.02 0.05 0.03 0.01 0.03 -0.01 -0.01 0.12 -0.06 -0.16 -0.04 -0.10 0.12 -0.01 -0.04 -0.01 0.01 0.00 0.01 0.31 0.15 0.03 0.02 0.10 -0.04 -0.12 0.09 -0.09 0.00 0.01 -0.00 -0.08 -0.01 0.03 0.08 -0.21 0.06 -0.03 0.00 0.03 0.04 -0.00 -0.03 0.04 0.00 -0.02 -0.11 0.14 0.12 -0.10 0.03 0.08 -0.07 0.01 -0.05 -0.00 -0.08 -0.03 -0.01 0.02 0.01 0.04 -0.04 -0.02 -0.04 -0.02 -0.03 -0.02 0.00 0.00 -0.00 -0.01 0.02 0.05 -0.08 -0.02 -0.04 0.08 0.01 0.01 0.00 -0.06 0.04 -0.04 -0.00 -0.10 -0.01 0.06 0.26 0.13 0.30 -0.14 0.15 -0.18 -0.05 -0.02 0.07 0.14 -0.34 -0.12 -0.31 0.26 0.01 0.01 -0.01 0.01 -0.06 0.15 0.02 -0.08 0.06 -0.14 0.13 -0.03 0.01 0.13 -0.05 -0.22 -0.08 -0.19 0.14 -0.03 0.09 -0.02 0.08 -0.12 0.05 -0.17 -0.07 -0.18 0.01 -0.12 0.11 0.14 -0.13 0.12 -0.01 0.01 -0.00 -0.06 -0.05 -0.02 -0.01 0.14 -0.03 0.00 -0.05 0.01 -0.03 0.02 0.01 0.03 0.01 0.03 0.02 -0.05 -0.05 0.04 0.02 -0.07 0.03 -0.02 -0.01 -0.02 -0.06 -0.02 0.02 -0.03 0.01 0.02 0.04 -0.00 0.01 0.00 0.03 -0.02 -0.02 -0.03 -0.05 0.02 0.03 0.12 -0.02 -0.03 -0.05 0.03 0.11 0.04 -0.07 -0.05 -0.12 0.14 0.16 -0.21 -0.03 -0.02 -0.14 -0.06 -0.33 0.20 -0.23 0.32 -0.07 -0.08 0.03 -0.04 0.21 0.08 0.07 -0.12 -0.01 -0.04 -0.02 -0.00 -0.03 -0.03 -0.03 0.02 -0.02 0.07 0.03 -0.10 0.01 0.04 0.08 0.09 0.06 0.07 -0.01 -0.01 0.01 -0.01 -0.07 -0.02 0.07 0.08 0.03 0.03 0.00 0.00 0.01 0.00 0.01 -0.04 -0.14 0.07 0.01 0.05 -0.01 -0.06 -0.10 -0.00 0.16 0.22 -0.24 -0.14 -0.05 -0.04 -0.20 0.01 -0.01 -0.02 -0.04 0.02 0.04 0.03 -0.01 -0.03 -0.03 0.02 0.01 0.07 0.02 0.02 0.03 -0.09 0.00 -0.00 -0.02 -0.08 0.43 0.31 0.41 -0.12 -0.10 -0.12 -0.11 0.24 -0.06 0.03 -0.02 -0.00 0.01 -0.00 0.02 -0.00 0.08 -0.11 0.01 -0.03 0.03 -0.10 0.00 0.03 0.07 0.01 0.10 -0.00 0.02 -0.05 0.04 -0.03 0.10 -0.04 -0.09 0.05 -0.09 0.13 0.00 -0.04 0.00 -0.01 0.02 -0.05 0.00 0.04 0.05 0.05 -0.07 0.05 0.01 -0.08 0.01 0.08 -0.05 0.00 -0.07 -0.13 0.11 -0.02 -0.04 -0.02 0.10 0.20 0.18 -0.10 0.03 -0.15 0.26 0.05 -0.01 -0.05 0.00 0.01 0.02 0.02 -0.04 -0.15 0.00 -0.10 -0.04 0.00 -0.01 0.03 0.04 -0.01 -0.03 0.01 -0.03 0.03 -0.16 0.02 0.06 0.43 -0.20 -0.28 -0.12 0.05 0.11 0.05 0.08 0.01 -0.02 0.03 -0.01 -0.14 0.08 -0.01 -0.09 -0.03 -0.05 0.09 0.05 0.09 0.11 -0.09 -0.06 0.04 -0.02 -0.00 0.08 -0.03 0.03 0.01 0.11 -0.08 0.00 -0.08 0.07 -0.08 -0.06 -0.02 0.18 0.13 0.16 0.11 -0.04 0.08 -0.03 -0.03 -0.09 0.02 -0.13 -0.09 -0.22 0.17 0.01 -0.02 0.01 0.00 0.01 -0.09 0.02 -0.06 -0.07 0.02 0.00 -0.09 -0.05 -0.08 0.06 0.21 0.01 0.11 -0.09 0.04 -0.03 0.02 0.01 0.01 -0.02 0.06 -0.12 -0.20 -0.05 0.08 -0.12 -0.02 0.01 0.04 0.01 -0.02 0.01 0.04 -0.01 -0.10 0.04 0.09 -0.08 -0.05 0.07 0.01 -0.01 0.02 0.08 0.01 0.00 0.01 0.06 -0.02 0.04 -0.16 0.09 0.13 0.02 -0.01 -0.00 -0.05 -0.03 -0.03 -0.00 0.03 -0.00 0.02 -0.05 0.01 -0.05 -0.05 -0.06 0.05 0.04 0.04 0.05 -0.02 -0.02 0.13 -0.08 0.00 0.01 -0.10 0.05 0.02 0.47 -0.33 -0.04 0.01 0.16 -0.36 0.08 0.17 0.06 -0.11 -0.23 -0.03 -0.07 0.09 0.04 -0.02 -0.04 0.00 0.18 0.04 0.05 -0.01 0.04 0.03 -0.03 0.05 0.12 0.04 0.01 -0.06 0.01 -0.09 -0.32 0.30 0.38 -0.09 -0.03 -0.07 -0.32 -0.21 -0.12 0.02 -0.00 -0.00 -0.03 0.08 0.06 0.05 0.01 0.01 -0.03 0.02 -0.05 0.02 -0.00 0.02 -0.00 0.01 -0.01 0.05 -0.06 -0.04 0.01 -0.07 -0.00 0.01 -0.02 -0.01 -0.02 0.00 -0.01 0.00 0.00 -0.00 0.04 -0.03 -0.03 -0.05 0.06 0.04 -0.03 0.01 0.00 -0.01 0.01 -0.02 0.03 -0.06 -0.02 -0.10 0.04 0.03 0.08 0.03 0.07 0.06 0.15 -0.12 -0.02 -0.00 -0.02 0.05 -0.06 -0.02 -0.04 -0.20 -0.04 -0.04 0.03 -0.04 0.01 0.11 -0.08 0.07 0.09 0.12 0.04 0.00 0.04 0.01 0.00 -0.00 -0.21 -0.37 -0.21 0.02 -0.09 -0.03 0.09 -0.03 -0.01 -0.03 -0.04 0.03 -0.01 0.03 -0.02 0.08 0.30 -0.03 0.06 -0.05 -0.04 0.03 0.04 -0.03 0.06 -0.03 0.05 0.03 -0.01 -0.00 -0.26 0.19 0.16 -0.15 0.02 0.19 -0.01 0.01 -0.04 0.03 -0.00 -0.03 -0.01 0.05 0.04 0.43 -0.07 -0.25 0.10 -0.04 -0.21 0.04 -0.12 0.09 -0.17 -0.09 -0.10 -0.01 -0.01 0.01 0.06 0.05 -0.00 -0.00 0.15 0.10 -0.04 0.02 0.04 -0.04 -0.04 -0.02 -0.03 -0.01 0.01 -0.02 -0.00 0.01 -0.12 -0.05 -0.00 0.05 0.02 0.06 0.05 -0.03 -0.05 0.03 -0.01 -0.05 -0.04 -0.06 0.09 0.03 -0.11 -0.01 0.03 -0.16 0.04 -0.06 0.02 -0.04 -0.15 0.05 0.09 -0.00 0.09 -0.17 0.03 0.09 0.02 0.11 0.06 -0.07 0.11 0.23 0.00 -0.02 -0.02 -0.03 -0.01 0.03 -0.00 0.08 0.09 0.00 0.08 -0.09 0.03 0.03 0.04 -0.01 0.03 -0.01 0.04 -0.00 0.02 -0.02 -0.11 0.02 0.15 -0.10 0.02 0.15 0.03 -0.03 0.04 0.05 -0.03 0.00 -0.08 -0.15 -0.02 0.10 -0.00 -0.08 -0.13 0.01 0.07 -0.06 0.35 -0.29 0.29 0.13 0.25 -0.03 0.06 -0.01 -0.06 0.11 0.02 0.09 0.04 -0.01 0.11 -0.02 -0.13 0.03 -0.21 0.14 -0.06 0.02 -0.01 -0.10 -0.24 0.03 0.15 0.07 0.03 0.04 0.06 0.06 0.08 -0.05 -0.10 0.01 -0.05 -0.01 -0.09 -0.09 -0.02 -0.02 -0.01 -0.06 0.01 0.06 -0.08 0.05 0.05 0.07 -0.11 0.05 0.10 0.04 0.02 -0.07 0.02 0.04 0.02 -0.21 0.02 0.08 -0.13 0.22 -0.02 -0.02 -0.01 -0.00 0.03 -0.03 0.01 0.12 0.13 0.12 -0.10 0.13 -0.04 -0.06 -0.05 0.01 -0.04 0.03 -0.04 -0.02 0.00 -0.01 -0.06 0.05 -0.03 -0.01 0.06 -0.05 0.01 -0.02 0.04 0.01 -0.02 -0.01 -0.07 -0.05 0.03 0.02 -0.06 -0.17 0.05 0.04 -0.14 -0.05 0.11 -0.08 0.08 0.08 0.15 0.01 0.00 0.02 -0.03 0.07 0.12 0.07 0.00 0.01 -0.00 0.00 0.01 -0.02 -0.04 0.00 0.22 0.02 -0.01 0.17 -0.05 -0.05 -0.11 -0.18 -0.02 -0.32 -0.22 -0.34 -0.25 0.20 0.37 0.01 0.02 -0.00 -0.02 -0.04 -0.01 0.03 0.00 0.03 0.00 -0.06 0.04 -0.01 -0.02 -0.04 -0.02 0.07 -0.03 0.02 -0.06 0.06 -0.01 -0.16 0.03 0.02 0.12 -0.02 -0.13 0.15 0.06 -0.04 -0.02 0.05 -0.03 0.04 -0.01 -0.09 0.11 -0.06 0.12 -0.05 -0.13 -0.01 0.02 -0.04 0.12 0.01 0.08 -0.02 0.01 -0.02 0.07 -0.05 -0.08 0.21 0.01 -0.13 -0.02 0.05 -0.03 0.06 -0.04 0.00 -0.03 -0.04 0.00 0.13 -0.07 -0.23 0.05 0.13 -0.04 -0.02 0.08 -0.06 0.07 0.04 0.07 0.09 -0.13 0.03 0.02 -0.10 0.06 -0.14 -0.02 0.01 -0.26 0.05 0.24 0.03 0.29 -0.20 -0.00 0.01 -0.01 -0.08 -0.04 0.09 0.04 0.01 0.04 -0.01 -0.03 0.02 0.00 -0.00 -0.00 -0.09 -0.06 0.03 -0.05 -0.12 0.09 -0.04 -0.02 0.07 -0.07 0.26 -0.20 0.22 0.08 0.15 0.18 -0.01 0.03 0.11 -0.08 0.10 0.07 0.08 0.11 0.05 0.22 0.08 -0.01 0.02 0.03 -0.02 0.02 -0.02 0.00 -0.01 -0.00 0.06 0.00 0.06 0.06 -0.10 0.00 0.00 0.03 0.04 0.08 0.07 0.03 -0.05 0.01 0.00 0.02 -0.00 0.03 -0.01 -0.02 -0.11 0.01 0.02 0.07 0.12 -0.12 0.05 0.02 0.09 0.03 -0.09 -0.00 0.03 0.13 -0.08 -0.20 0.05 -0.15 0.13 -0.18 -0.07 -0.12 -0.03 0.08 0.02 -0.07 0.17 0.01 0.15 -0.01 -0.01 0.17 -0.03 -0.13 -0.07 -0.23 0.10 0.01 0.01 -0.00 0.13 -0.09 -0.06 -0.09 -0.00 0.01 -0.01 -0.01 -0.01 -0.02 0.02 0.02 -0.06 -0.14 0.04 -0.12 -0.12 -0.08 -0.10 0.07 -0.05 -0.06 0.35 -0.25 0.23 0.09 0.24 -0.07 0.05 -0.09 0.20 -0.02 0.03 0.06 0.03 0.10 0.12 -0.04 -0.15 -0.11 0.11 -0.00 -0.04 0.04 -0.10 -0.01 -0.01 0.02 0.13 0.01 0.11 -0.01 -0.02 0.06 0.02 -0.00 0.02 -0.04 0.01 0.02 -0.03 0.06 -0.07 -0.02 -0.25 0.29 -0.12 -0.02 0.37 0.02 -0.05 0.03 0.01 -0.00 -0.03 0.06 0.01 -0.02 0.14 0.19 0.23 0.00 0.18 0.24 -0.03 -0.01 0.07 -0.06 -0.03 -0.02 0.02 -0.09 -0.03 0.00 -0.01 -0.06 -0.10 0.01 -0.13 -0.11 0.01 0.10 0.05 0.15 -0.09 0.04 0.02 0.01 0.09 -0.05 -0.13 -0.10 -0.09 -0.13 -0.05 -0.01 -0.06 -0.03 0.02 0.07 0.04 -0.09 -0.04 -0.01 -0.03 -0.11 -0.02 0.05 -0.16 -0.00 0.09 -0.08 -0.01 0.04 0.09 -0.10 -0.02 0.32 0.01 0.00 -0.05 -0.02 -0.04 0.04 0.06 0.13 0.17 0.03 0.04 -0.06 -0.07 0.01 -0.02 0.02 -0.01 -0.01 -0.08 0.03 -0.02 -0.05 0.10 -0.09 -0.05 -0.02 -0.01 0.01 -0.04 -0.05 0.01 0.00 0.00 0.17 -0.40 0.04 0.12 -0.06 -0.14 0.02 0.00 -0.01 -0.02 0.03 0.03 0.01 0.01 -0.01 0.45 0.13 -0.02 -0.14 -0.08 0.10 0.02 -0.01 0.00 -0.02 -0.01 -0.05 -0.05 0.07 -0.03 -0.15 0.03 0.11 -0.08 0.06 0.06 0.08 0.01 -0.09 0.03 -0.14 0.12 0.02 -0.03 0.01 -0.09 0.12 0.03 -0.03 -0.06 -0.02 0.00 -0.03 -0.01 -0.01 0.00 0.02 -0.04 0.03 0.00 0.09 0.04 0.14 0.05 0.02 0.11 -0.05 0.05 -0.02 0.03 -0.01 -0.03 0.11 -0.07 -0.09 -0.06 -0.16 0.16 0.01 -0.01 -0.06 -0.12 -0.20 -0.07 -0.33 0.16 0.00 -0.03 0.05 -0.00 0.03 -0.00 -0.02 -0.07 -0.02 0.00 -0.05 -0.03 0.15 0.02 0.03 0.01 0.01 -0.01 -0.01 0.00 -0.01 -0.01 0.18 -0.26 -0.12 -0.20 0.27 -0.04 0.04 -0.10 0.05 -0.06 0.04 0.04 -0.05 0.00 0.02 0.05 0.08 0.04 0.21 -0.01 -0.18 0.00 0.02 -0.03 -0.03 -0.01 0.01 0.02 -0.05 0.00 0.01 0.16 0.14 -0.04 0.02 0.04 -0.05 -0.01 0.05 -0.03 0.02 -0.07 -0.03 0.01 -0.03 0.10 -0.26 0.07 0.05 0.06 0.07 0.06 0.06 0.02 0.01 -0.02 -0.05 0.01 0.05 0.03 -0.09 -0.06 -0.04 -0.04 0.01 -0.03 0.07 -0.12 0.00 -0.01 -0.08 -0.08 -0.24 0.33 -0.07 -0.08 -0.23 0.28 0.00 0.00 -0.02 0.21 0.09 -0.05 -0.15 0.10 0.06 -0.01 -0.01 0.00 0.01 -0.02 -0.03 0.04 0.06 0.02 -0.04 -0.02 0.08 0.01 0.02 0.01 0.03 -0.01 -0.04 0.03 -0.05 0.04 -0.06 0.05 0.14 -0.10 0.03 -0.30 -0.02 0.01 -0.02 0.03 -0.04 0.01 0.03 -0.00 -0.02 -0.04 -0.05 -0.11 -0.01 0.04 0.31 -0.03 -0.00 0.03 0.02 -0.01 0.00 -0.01 -0.05 -0.03 0.10 0.36 -0.03 -0.05 -0.07 -0.01 -0.05 0.01 0.03 0.05 0.01 0.00 -0.02 -0.01 0.02 0.10 0.02 -0.14 -0.02 -0.02 -0.07 0.02 0.04 0.01 0.01 -0.01 -0.02 -0.02 0.02 0.02 -0.01 0.02 0.09 -0.01 -0.04 0.04 -0.01 0.00 0.00 0.03 -0.02 -0.02 -0.18 0.17 -0.38 0.05 0.03 -0.04 0.01 0.01 -0.02 0.09 -0.06 0.16 0.11 0.51 -0.04 0.02 -0.01 0.04 0.02 0.00 0.02 -0.07 -0.00 -0.06 0.11 -0.06 -0.06 -0.01 0.01 0.03 0.03 0.04 0.04 0.02 -0.02 0.01 0.12 0.04 -0.27 -0.25 0.36 0.15 0.06 -0.06 0.04 -0.01 -0.02 0.02 0.06 0.02 -0.03 -0.03 -0.10 -0.14 -0.19 -0.02 0.22 -0.02 -0.04 0.05 -0.01 0.01 -0.02 -0.02 0.01 -0.03 -0.04 -0.03 0.14 -0.01 0.03 0.02 0.02 0.01 -0.03 0.04 -0.02 0.04 0.04 -0.00 0.00 -0.09 0.29 0.04 -0.01 -0.07 -0.07 -0.01 -0.02 -0.03 -0.01 0.02 0.03 0.02 -0.07 -0.01 -0.06 -0.17 0.01 -0.09 0.02 -0.15 0.04 -0.01 -0.05 0.03 -0.00 0.04 -0.24 0.36 0.09 -0.01 0.10 -0.11 0.03 -0.02 0.08 -0.13 -0.16 0.02 -0.20 0.00 0.05 0.02 -0.01 -0.02 0.06 0.02 0.05 0.01 -0.06 -0.02 0.03 0.15 -0.34 -0.07 -0.07 -0.02 -0.02 -0.00 -0.05 0.00 -0.01 0.01 0.01 0.03 -0.06 -0.14 -0.09 0.10 0.01 -0.00 0.01 0.01 -0.01 0.00 0.01 0.01 -0.02 -0.04 0.04 0.09 0.20 -0.08 0.01 -0.01 0.01 0.00 -0.03 0.01 0.01 0.01 -0.04 0.01 -0.02 0.34 -0.11 -0.02 -0.06 -0.06 -0.05 -0.01 0.03 -0.01 0.01 -0.02 0.01 -0.03 0.02 -0.33 0.00 0.14 0.08 -0.05 0.11 -0.05 -0.05 -0.02 0.01 0.03 -0.01 0.02 -0.03 -0.03 -0.10 -0.03 -0.02 0.17 0.13 0.11 -0.05 0.01 0.03 -0.02 0.04 0.02 -0.20 0.05 -0.05 0.01 0.06 -0.07 0.03 0.06 -0.21 0.28 -0.12 -0.05 -0.05 0.38 -0.13 -0.02 0.01 -0.06 -0.01 0.02 0.03 0.08 -0.02 0.03 0.01 0.08 -0.16 -0.03 -0.02 -0.01 0.01 0.02 0.05 0.03 -0.05 0.02 -0.11 0.01 0.28 -0.06 0.36 -0.27 -0.01 -0.00 -0.03 0.02 -0.05 0.01 -0.00 -0.01 -0.00 -0.02 0.07 0.23 0.02 -0.06 -0.08 0.00 0.02 -0.02 -0.01 0.00 0.02 -0.03 -0.00 -0.04 0.21 -0.21 0.03 0.02 0.07 0.11 0.02 0.00 -0.02 -0.02 0.03 -0.03 0.01 -0.01 0.01 -0.22 0.01 -0.04 0.03 -0.03 0.04 -0.04 -0.03 -0.01 0.01 0.02 0.00 -0.00 -0.02 0.01 0.11 -0.03 0.03 -0.07 0.00 -0.03 0.01 0.02 -0.02 0.04 -0.04 -0.01 -0.06 0.32 -0.14 0.02 0.04 -0.09 0.00 0.00 0.09 0.01 -0.06 -0.07 0.30 -0.36 0.10 -0.01 -0.04 0.02 -0.01 -0.05 -0.01 -0.04 -0.01 -0.03 0.03 -0.12 0.17 0.04 0.01 0.04 -0.01 0.04 0.05 0.01 0.00 0.01 0.01 -0.03 0.01 -0.11 -0.07 -0.01 0.01 0.02 0.00 0.02 -0.05 0.00 -0.09 -0.06 0.04 0.08 0.02 0.10 0.10 -0.13 -0.16 -0.03 0.02 -0.06 0.07 0.03 0.05 0.03 -0.03 0.02 -0.01 0.17 -0.07 -0.03 -0.01 0.02 -0.05 -0.00 0.04 -0.01 0.02 -0.03 0.03 0.04 -0.04 -0.08 0.38 0.08 0.06 -0.06 0.02 0.01 0.02 -0.04 -0.00 0.01 0.02 -0.01 -0.04 -0.00 0.21 0.30 -0.10 -0.16 -0.08 -0.15 0.02 0.06 -0.04 0.00 -0.02 0.03 -0.09 -0.04 -0.19 0.05 0.34 -0.37 -0.03 -0.08 0.17 0.10 -0.09 -0.10 0.01 0.18 -0.06 -0.02 -0.01 0.02 0.04 0.01 0.03 -0.02 -0.00 0.04 -0.12 0.17 -0.23 -0.03 -0.06 -0.02 -0.04 0.01 0.01 -0.01 0.01 -0.00 -0.04 -0.03 -0.01 -0.10 0.10 0.02 0.01 0.02 0.02 0.03 -0.07 -0.01 -0.03 -0.03 0.00 0.03 -0.06 -0.06 -0.15 -0.01 -0.06 -0.00 -0.01 -0.03 0.04 0.01 0.01 0.03 -0.01 0.00 0.04 -0.01 0.07 -0.00 0.02 0.05 -0.01 0.00 0.02 0.02 0.01 -0.01 -0.09 -0.09 0.06 0.38 0.04 0.04 -0.02 0.05 0.04 0.06 0.03 0.05 -0.01 -0.03 -0.07 0.01 -0.08 -0.03 0.07 0.24 -0.21 0.10 0.10 0.08 -0.04 0.06 -0.01 0.01 -0.02 0.03 -0.09 0.10 -0.03 0.08 0.40 -0.45 -0.02 0.15 -0.16 -0.18 0.04 0.02 0.04 -0.01 0.06 0.00 0.05 -0.05 -0.01 0.00 -0.01 0.02 -0.03 0.00 -0.08 0.03 -0.01 -0.02 0.02 0.00 0.11 -0.08 -0.13 -0.01 0.01 -0.02 0.13 0.12 -0.11 -0.06 0.03 0.13 0.03 0.00 0.00 -0.01 -0.02 -0.00 -0.08 -0.07 0.06 -0.04 0.14 0.17 -0.01 -0.07 -0.19 0.01 0.03 -0.06 0.07 -0.01 0.04 0.05 0.00 0.03 0.01 0.03 0.02 -0.04 -0.05 -0.02 -0.02 0.00 0.01 -0.00 0.01 -0.02 -0.05 -0.04 0.04 0.13 0.18 -0.45 -0.01 -0.00 0.02 0.00 0.03 0.03 0.01 -0.00 -0.04 -0.00 -0.06 -0.06 0.05 -0.12 0.56 0.07 0.01 0.06 -0.05 -0.00 -0.03 0.01 0.06 0.02 -0.10 0.08 0.11 0.02 0.17 -0.17 0.06 0.09 -0.15 -0.11 0.06 -0.00 -0.04 -0.01 0.00 -0.01 -0.00 0.00 0.02 0.01 0.02 -0.01 0.01 0.02 -0.09 0.15 -0.07 -0.02 -0.02 -0.00 -0.02 0.03 0.08 -0.00 0.00 0.01 0.02 0.04 -0.15 -0.05 -0.03 0.05 0.02 0.01 0.02 0.00 -0.03 -0.00 0.02 0.02 -0.01 -0.03 -0.02 -0.11 0.24 0.12 0.15 -0.01 0.01 0.02 -0.03 -0.01 -0.00 -0.07 0.01 -0.03 -0.06 -0.06 0.01 0.03 0.03 -0.05 0.03 -0.01 -0.03 -0.03 -0.01 0.03 -0.01 -0.00 0.00 -0.02 -0.25 0.04 0.02 0.01 0.03 -0.00 -0.01 0.01 0.00 0.00 -0.00 0.00 -0.05 -0.02 0.38 0.16 0.23 -0.20 -0.09 -0.13 0.01 0.03 -0.03 0.01 -0.00 0.02 0.02 -0.10 -0.06 0.02 0.36 -0.40 -0.03 -0.08 0.18 0.26 0.04 0.05 -0.07 -0.08 0.01 0.03 -0.00 0.03 0.00 0.01 -0.00 -0.01 0.01 -0.00 -0.02 -0.06 -0.03 0.01 0.01 -0.00 0.03 -0.01 -0.04 -0.02 -0.02 0.01 -0.02 -0.04 -0.01 0.06 0.03 0.00 -0.02 -0.02 0.01 -0.00 0.03 0.01 -0.06 -0.04 0.02 0.04 -0.03 -0.03 0.42 0.11 0.16 -0.06 0.01 -0.02 0.02 0.01 0.05 -0.12 0.00 -0.07 -0.03 -0.16 0.01 0.09 0.11 -0.01 0.03 -0.01 -0.03 -0.04 -0.02 0.02 -0.05 -0.00 0.00 0.09 0.24 -0.11 0.11 -0.13 0.04 0.01 0.05 -0.00 0.01 -0.00 -0.04 0.00 -0.00 0.01 -0.15 0.02 -0.09 0.08 0.05 0.09 -0.02 -0.00 -0.01 0.00 -0.01 0.00 0.06 -0.02 0.13 -0.02 -0.32 0.35 0.02 0.16 -0.16 0.40 0.04 0.07 0.02 -0.23 0.04 0.00 0.00 -0.00 -0.06 -0.03 -0.02 -0.01 -0.00 -0.02 -0.02 -0.07 0.15 0.03 0.00 0.01 0.07 -0.07 -0.16 0.01 0.01 0.02 -0.04 -0.01 -0.03 -0.05 0.09 0.01 0.01 0.03 0.01 0.01 -0.07 -0.01 0.02 0.02 -0.01 -0.01 -0.00 -0.01 -0.00 0.02 0.02 0.00 -0.00 0.01 -0.01 0.00 -0.01 -0.01 -0.01 -0.01 -0.02 -0.06 -0.01 0.02 0.03 0.04 0.00 -0.00 0.00 -0.00 0.01 -0.00 0.03 0.03 -0.03 -0.07 -0.08 0.08 -0.00 0.01 -0.03 -0.01 -0.01 -0.01 -0.00 0.01 0.02 -0.01 -0.06 -0.03 -0.02 0.16 0.07 0.18 0.09 0.14 -0.04 0.03 0.01 0.01 -0.00 0.01 -0.07 0.13 -0.01 0.04 0.56 -0.65 0.05 -0.01 -0.16 0.01 -0.00 -0.01 -0.02 -0.09 -0.01 -0.03 -0.00 -0.06 -0.01 0.00 0.00 0.02 -0.01 -0.02 -0.02 -0.02 0.02 0.00 0.00 0.00 0.04 -0.02 -0.04 -0.03 -0.00 -0.04 -0.02 0.03 0.02 0.01 -0.02 0.04 -0.01 -0.03 -0.01 -0.01 0.03 -0.01 0.00 0.00 -0.01 -0.03 -0.01 -0.01 0.00 -0.03 0.02 -0.01 -0.01 0.00 -0.00 0.01 -0.00 -0.01 0.02 -0.00 0.17 0.01 0.11 -0.02 -0.03 -0.04 0.01 0.01 -0.01 0.01 -0.01 0.01 0.00 0.01 -0.01 0.06 0.04 0.19 0.02 -0.02 0.01 0.01 -0.00 -0.01 -0.01 -0.00 -0.00 0.01 -0.01 -0.01 0.02 0.03 0.09 -0.01 0.01 0.02 -0.03 -0.00 -0.03 -0.00 0.01 0.01 0.00 -0.04 0.10 0.01 -0.59 0.69 0.02 0.04 -0.05 0.04 -0.07 -0.04 0.13 0.04 0.08 0.01 -0.01 0.03 -0.02 0.00 -0.00 -0.02 0.00 0.01 0.03 0.01 0.01 0.00 0.00 -0.00 -0.02 0.00 0.02 -0.05 0.03 -0.02 0.02 -0.03 -0.03 0.01 -0.05 0.01 -0.01 0.04 0.01 -0.02 -0.09 -0.05 -0.00 -0.00 0.01 0.03 0.02 -0.01 0.05 -0.03 0.02 0.01 0.01 0.00 0.00 -0.01 -0.00 -0.02 0.03 -0.00 0.20 0.01 0.14 -0.05 -0.07 -0.05 0.02 0.02 -0.02 -0.01 -0.00 0.02 0.00 0.00 0.00 -0.05 -0.01 -0.07 -0.02 0.03 -0.01 -0.01 -0.00 0.01 0.00 -0.00 0.00 -0.01 0.01 0.00 0.01 -0.05 -0.06 0.04 0.00 -0.00 0.02 0.00 0.03 -0.00 -0.00 -0.00 0.04 -0.07 -0.06 0.08 0.61 -0.66 -0.02 -0.03 0.04 0.03 -0.04 -0.00 0.16 -0.05 0.14 0.03 0.01 0.06 -0.00 -0.01 -0.00 -0.02 0.01 0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 0.00 -0.05 0.02 -0.05 -0.00 -0.02 -0.09 0.01 -0.07 0.03 -0.03 -0.03 0.01 0.02 0.04 0.02 0.01 0.01 -0.00 -0.01 -0.02 0.03 -0.10 -0.02 -0.01 0.01 0.00 0.01 -0.01 -0.01 0.01 -0.02 -0.06 -0.05 0.11 0.08 0.05 0.17 0.15 0.20 -0.01 -0.01 0.02 0.02 0.01 -0.03 0.01 0.00 0.00 -0.10 -0.06 -0.15 0.01 -0.02 -0.03 -0.01 0.00 0.00 0.01 0.01 0.00 0.01 -0.02 0.00 0.05 0.09 -0.02 -0.01 0.01 0.02 -0.02 0.01 -0.03 -0.00 -0.01 0.02 0.02 -0.09 0.09 0.03 -0.53 0.67 -0.00 -0.09 0.06 -0.06 0.01 0.03 0.10 0.05 0.05 0.01 -0.02 0.06 -0.01 -0.01 -0.01 -0.02 0.02 0.01 -0.00 -0.01 0.01 0.00 -0.00 -0.00 -0.01 0.00 -0.00 0.02 -0.03 -0.00 0.02 0.04 0.00 -0.04 0.06 0.00 -0.00 -0.02 -0.01 0.01 0.07 0.01 0.00 0.00 0.01 0.04 0.01 -0.03 0.01 -0.00 -0.01 0.01 0.01 0.01 -0.00 -0.01 0.00 0.01 0.04 0.03 0.01 -0.03 0.00 -0.10 -0.11 -0.11 0.01 0.01 -0.01 -0.01 -0.01 0.02 0.01 0.00 0.00 -0.07 -0.05 -0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.01 0.01 -0.03 -0.01 0.04 0.10 -0.07 0.03 0.03 0.03 -0.03 0.01 -0.03 -0.00 0.00 0.01 -0.05 0.05 0.07 -0.02 -0.61 0.72 -0.00 -0.06 0.04 -0.02 0.01 0.01 0.01 -0.01 -0.00 -0.01 0.01 -0.02 -0.09 -0.01 -0.02 -0.01 -0.03 0.00 0.09 0.06 0.05 0.00 0.01 -0.01 -0.03 -0.01 0.02 0.01 -0.02 0.00 -0.05 0.01 -0.04 -0.04 0.02 -0.00 -0.00 -0.02 -0.00 0.02 0.04 0.02 -0.04 -0.05 0.01 0.04 -0.05 0.05 0.14 0.01 0.01 0.00 -0.00 -0.02 0.06 -0.01 -0.02 -0.02 -0.02 -0.02 -0.05 0.04 -0.03 0.03 0.04 0.02 -0.01 0.00 0.01 0.01 -0.01 -0.00 0.05 -0.08 0.06 0.01 0.09 0.07 -0.16 0.45 -0.22 0.00 -0.04 0.01 -0.01 -0.00 0.03 -0.00 -0.01 0.01 0.21 -0.18 -0.07 0.11 0.06 0.07 -0.02 0.01 -0.00 0.00 0.01 0.01 -0.01 -0.02 0.02 -0.02 -0.40 0.45 -0.04 -0.24 0.23 0.06 0.09 0.13 -0.05 0.08 -0.03 0.00 0.01 -0.03 0.12 -0.12 -0.22 0.02 -0.04 -0.00 0.04 -0.06 0.02 -0.02 0.07 -0.02 -0.39 0.19 0.48 -0.00 0.00 -0.00 0.01 0.02 0.02 -0.00 0.05 0.02 -0.00 0.00 0.00 -0.00 -0.01 -0.01 -0.00 -0.00 0.00 -0.02 0.04 -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 0.02 -0.04 0.01 0.01 -0.01 0.02 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 0.01 0.00 -0.02 0.01 0.06 -0.00 0.04 -0.03 0.01 -0.00 -0.02 0.00 -0.00 0.01 -0.01 -0.04 -0.02 -0.14 0.12 0.21 0.18 0.06 0.11 -0.05 -0.00 -0.02 -0.00 0.01 0.00 -0.10 0.14 0.11 -0.00 -0.03 0.02 -0.30 -0.01 0.45 0.01 -0.01 -0.01 0.01 -0.03 0.01 -0.02 -0.01 -0.02 -0.13 0.03 -0.06 -0.00 -0.00 0.03 -0.02 -0.03 0.06 0.01 0.06 -0.04 -0.08 0.00 0.14 0.01 -0.00 -0.00 0.02 0.03 -0.02 -0.06 0.01 0.01 0.01 -0.01 -0.01 0.01 0.01 0.01 0.02 0.02 -0.01 -0.02 -0.00 0.00 -0.06 0.00 0.00 -0.01 -0.01 0.00 -0.03 0.02 0.01 0.01 -0.01 -0.00 -0.05 0.06 -0.03 0.02 -0.00 0.04 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.05 0.09 -0.06 0.09 0.00 0.00 0.11 -0.32 0.19 -0.00 0.02 0.02 -0.00 -0.02 -0.02 -0.01 -0.00 0.01 0.44 -0.33 -0.13 0.20 0.12 0.17 -0.02 0.00 0.01 0.00 0.02 -0.01 0.02 -0.07 -0.09 -0.01 -0.01 0.01 -0.17 0.51 -0.06 0.03 -0.07 -0.09 -0.06 0.11 -0.04 -0.04 -0.07 -0.00 0.00 0.01 0.01 -0.01 0.01 0.00 -0.01 -0.00 0.01 0.00 -0.01 0.00 0.01 -0.02 0.00 0.01 0.07 -0.06 0.18 0.11 0.11 -0.01 0.01 0.02 0.03 -0.02 -0.03 0.01 0.03 0.03 -0.00 0.00 0.01 -0.03 0.09 -0.07 0.05 0.01 0.01 0.01 0.01 0.01 0.00 -0.01 -0.00 -0.03 -0.01 -0.03 -0.04 -0.02 -0.03 0.01 -0.22 0.25 0.01 0.01 0.01 -0.00 0.01 0.01 0.01 -0.01 0.01 -0.01 -0.00 0.01 -0.00 0.03 -0.04 -0.00 -0.02 -0.01 0.00 0.00 0.00 -0.02 0.00 0.01 -0.01 0.02 -0.03 0.04 -0.01 -0.05 -0.00 -0.01 0.01 -0.00 0.02 -0.01 -0.00 0.01 -0.03 0.02 0.07 0.01 -0.04 0.72 -0.46 0.03 -0.05 -0.06 -0.03 -0.20 -0.00 -0.00 0.02 0.00 -0.01 -0.03 -0.00 0.00 -0.01 -0.01 0.09 0.07 0.04 -0.00 -0.02 0.02 -0.00 0.01 -0.03 0.00 0.02 -0.02 -0.02 0.00 -0.01 -0.00 0.01 -0.00 0.00 -0.00 -0.00 0.01 0.01 0.00 0.12 -0.11 -0.13 0.03 -0.03 0.02 0.05 0.01 0.03 -0.03 0.00 -0.04 0.02 0.01 0.02 -0.02 -0.01 -0.02 -0.01 -0.00 -0.00 0.01 -0.06 0.09 0.00 0.00 0.01 0.01 -0.00 -0.00 0.00 0.07 -0.05 0.03 0.07 -0.05 -0.42 0.13 0.59 0.02 -0.03 0.03 -0.02 -0.03 -0.01 -0.01 -0.00 0.01 -0.05 0.04 0.02 0.04 -0.03 -0.07 -0.00 0.01 -0.00 0.00 -0.00 0.01 -0.03 0.03 0.04 -0.00 -0.12 0.14 0.03 -0.48 0.27 0.02 0.00 0.02 0.01 -0.03 0.01 0.01 0.01 0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.02 0.02 0.00 -0.01 0.00 0.00 -0.02 0.02 -0.00 -0.01 0.01 -0.04 -0.02 -0.02 -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 -0.01 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 0.02 -0.03 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 -0.00 -0.01 0.01 0.00 -0.01 -0.02 -0.00 -0.00 -0.00 0.00 -0.02 0.00 0.01 0.00 0.01 0.01 0.04 -0.01 -0.06 -0.00 0.00 -0.01 0.00 -0.00 0.01 -0.01 0.01 0.02 -0.00 -0.06 0.06 -0.06 0.84 -0.52 -0.01 0.01 0.01 0.00 0.03 -0.00 -0.06 -0.05 0.00 0.00 0.00 -0.00 -0.02 0.01 0.01 -0.03 -0.04 0.00 0.00 0.00 -0.00 0.01 -0.00 0.01 0.04 0.03 0.09 0.24 0.10 0.09 0.01 -0.01 0.03 -0.00 -0.02 0.01 -0.21 -0.23 -0.20 0.01 -0.01 -0.01 -0.03 0.03 -0.04 -0.01 -0.00 -0.01 0.01 0.01 0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.00 0.03 0.01 -0.01 0.05 0.21 -0.10 -0.01 -0.02 0.00 -0.02 0.01 0.01 0.01 -0.00 0.00 -0.02 -0.00 -0.02 -0.06 0.05 0.03 0.00 -0.01 -0.01 0.00 0.00 0.00 0.01 -0.00 -0.01 0.01 0.01 -0.05 -0.05 0.03 0.06 -0.01 0.00 -0.01 -0.00 0.02 -0.02 -0.00 0.04 -0.10 -0.10 -0.52 0.33 -0.03 0.42 -0.23 0.02 0.06 0.07 0.05 0.20 -0.02 -0.04 -0.02 -0.01 0.01 0.00 -0.01 -0.01 0.00 0.01 -0.03 -0.04 -0.00 0.00 0.00 -0.00 0.01 -0.00 0.02 -0.06 -0.08 -0.02 0.15 0.06 0.06 0.00 -0.01 0.01 0.02 -0.01 -0.02 0.12 0.15 0.15 0.01 -0.01 -0.01 -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 -0.00 0.00 0.03 -0.00 0.01 0.02 0.13 -0.09 -0.00 -0.00 -0.00 -0.01 0.01 0.01 0.01 -0.00 0.00 -0.02 0.00 -0.01 -0.05 0.04 0.03 0.00 -0.01 -0.01 0.00 0.00 0.00 0.02 0.00 -0.01 -0.01 0.01 -0.03 -0.07 0.03 0.07 0.01 -0.03 0.01 -0.00 0.01 -0.01 0.08 -0.12 -0.00 0.11 0.63 -0.44 -0.03 0.41 -0.21 -0.00 0.00 0.00 0.04 0.15 0.00 -0.03 -0.03 -0.01 -0.02 -0.01 0.01 -0.01 0.01 0.01 0.09 0.10 0.01 -0.01 -0.02 0.01 -0.02 -0.00 -0.04 -0.02 -0.04 0.01 0.11 0.06 0.04 -0.00 0.01 -0.00 0.01 -0.01 -0.01 0.01 0.02 0.02 -0.01 0.01 0.01 -0.01 0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 0.00 -0.00 -0.00 0.02 -0.00 -0.00 0.03 0.10 -0.05 -0.00 -0.01 0.00 -0.01 0.01 0.01 -0.01 0.00 -0.00 0.02 -0.01 0.00 0.05 -0.05 -0.02 0.00 0.01 0.01 -0.00 -0.00 -0.00 -0.08 0.01 0.05 -0.01 0.03 0.01 0.25 -0.09 -0.21 -0.01 -0.00 -0.01 0.01 -0.00 0.01 -0.03 0.01 0.10 0.04 0.03 0.06 0.07 -0.77 0.36 0.02 0.00 -0.01 0.02 0.25 -0.04 0.08 -0.16 0.06 0.03 0.06 0.03 0.06 -0.02 -0.05 -0.18 -0.21 -0.06 0.00 0.03 -0.03 -0.01 0.01 0.01 -0.01 -0.04 0.01 -0.20 -0.12 -0.05 -0.01 0.01 -0.02 -0.01 0.00 0.00 0.04 0.03 0.02 0.02 -0.02 -0.02 -0.17 0.63 -0.22 -0.01 -0.02 -0.02 0.04 0.03 0.04 -0.00 -0.03 0.00 0.02 -0.02 -0.01 -0.01 0.02 0.03 0.04 0.10 -0.04 0.00 -0.02 -0.00 -0.07 0.04 0.05 0.02 -0.01 0.01 0.03 0.06 0.05 -0.08 0.08 0.03 0.00 0.01 -0.01 -0.01 0.00 -0.01 -0.02 0.01 0.01 0.06 -0.06 0.02 0.08 -0.03 -0.04 0.00 0.01 0.00 0.00 -0.01 0.01 0.04 -0.08 0.05 -0.02 -0.08 0.05 0.06 -0.37 0.13 -0.12 0.17 0.23 0.02 -0.04 0.05 0.02 -0.09 0.02 -0.11 -0.14 -0.06 0.03 -0.00 -0.03 0.45 0.51 0.14 0.00 -0.04 0.03 0.04 -0.02 -0.03 -0.01 -0.02 0.00 -0.05 -0.03 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 0.01 0.01 0.01 -0.01 0.01 0.01 -0.08 0.29 -0.10 -0.01 -0.01 -0.01 0.02 0.01 0.02 -0.01 -0.00 -0.00 0.01 -0.01 -0.01 -0.00 0.00 0.01 0.02 0.05 -0.01 0.00 -0.01 -0.00 -0.03 0.02 0.02 -0.05 0.01 0.01 0.07 0.01 0.02 0.08 -0.08 -0.01 0.02 -0.03 -0.01 -0.01 -0.03 -0.01 0.06 -0.02 -0.04 -0.10 0.01 0.00 -0.23 0.06 0.13 0.02 0.01 0.02 -0.01 0.02 -0.02 0.04 -0.04 -0.01 0.00 -0.04 0.05 -0.13 0.45 -0.02 -0.03 0.05 0.07 0.02 -0.02 0.03 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 -0.00 0.01 -0.00 -0.01 -0.01 -0.01 0.00 0.01 0.00 0.01 -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 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.02 -0.04 -0.02 0.00 -0.02 0.02 0.00 0.01 -0.00 -0.02 0.01 0.02 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.06 -0.06 -0.05 -0.00 0.01 -0.01 0.00 0.00 -0.00 0.03 -0.01 -0.01 -0.09 0.97 -0.19 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 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 -0.04 0.00 -0.00 0.00 0.00 -0.01 0.04 -0.03 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 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 0.01 -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 0.01 -0.00 0.00 -0.01 0.00 0.00 -0.00 -0.38 0.52 0.76 -0.05 0.01 -0.03 0.00 0.00 -0.01 0.01 -0.00 -0.00 -0.01 0.01 0.01 -0.01 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 0.00 -0.01 0.00 -0.00 -0.01 -0.02 -0.00 -0.00 0.00 0.01 0.01 0.00 0.00 -0.01 0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.02 -0.01 0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.01 -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 0.01 -0.00 -0.00 -0.00 -0.11 -0.07 -0.08 -0.01 -0.01 0.00 -0.02 0.00 0.02 0.36 0.17 0.30 0.00 0.08 -0.08 -0.30 0.19 0.61 0.08 -0.20 0.40 -0.00 0.02 -0.01 0.04 -0.05 -0.07 -0.03 0.05 -0.02 -0.01 -0.01 0.00 0.00 -0.01 -0.01 0.03 -0.00 -0.01 0.02 0.03 -0.02 0.00 -0.01 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 -0.01 0.00 0.00 0.00 0.02 -0.10 0.05 -0.01 0.01 -0.01 -0.01 0.02 0.01 0.04 0.03 0.05 -0.09 0.29 -0.20 0.01 0.01 -0.02 0.00 0.01 0.00 0.00 0.01 0.00 -0.01 -0.04 0.03 -0.02 0.00 0.02 0.15 -0.10 -0.13 0.03 -0.01 0.00 0.02 -0.02 -0.00 -0.42 0.33 0.48 -0.09 -0.05 -0.07 0.01 0.00 0.00 -0.01 0.01 0.00 -0.02 0.00 0.00 -0.03 -0.01 -0.02 -0.00 -0.00 0.00 0.04 -0.04 -0.05 0.01 0.00 0.01 -0.03 0.19 -0.10 0.08 -0.26 -0.36 0.06 0.00 0.03 0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.01 -0.01 -0.01 -0.02 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.01 0.00 -0.00 -0.00 0.01 -0.12 0.05 -0.01 0.00 -0.00 -0.01 0.03 0.00 0.08 0.06 0.09 -0.11 0.33 -0.23 -0.00 0.03 -0.01 0.00 0.01 0.00 0.00 0.01 0.00 -0.01 -0.08 0.05 0.03 -0.01 -0.03 -0.05 0.03 0.04 -0.02 -0.03 -0.01 0.01 0.00 -0.02 0.14 -0.11 -0.16 0.03 0.02 0.03 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 -0.01 0.01 0.05 -0.04 -0.06 0.01 -0.01 0.02 0.01 -0.02 0.01 0.16 -0.46 -0.66 0.09 0.09 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 -0.01 0.01 -0.00 0.00 0.00 0.02 -0.01 -0.01 0.02 -0.00 -0.00 0.00 0.01 0.01 -0.05 0.03 0.05 0.00 0.00 0.01 -0.03 0.01 -0.04 -0.03 0.06 -0.01 0.01 -0.01 -0.01 0.07 0.04 0.08 0.02 -0.05 0.04 -0.13 0.08 0.10 0.01 -0.02 -0.01 0.01 0.03 0.01 -0.00 -0.13 0.08 0.41 -0.14 -0.40 0.01 -0.00 -0.00 0.00 0.01 0.00 0.00 -0.01 0.00 -0.03 0.02 0.03 -0.02 -0.01 -0.02 -0.00 -0.01 0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.02 0.01 0.01 -0.00 0.04 -0.04 0.07 -0.04 -0.14 -0.06 0.02 -0.12 -0.00 -0.01 0.01 -0.08 0.13 0.19 -0.15 0.64 -0.16 -0.01 -0.01 -0.00 -0.00 -0.04 0.02 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.08 -0.07 -0.00 0.00 0.01 -0.04 0.02 0.04 0.02 0.04 0.00 -0.01 0.00 -0.00 0.14 -0.06 -0.14 0.00 0.00 -0.01 0.02 0.02 0.02 -0.00 0.03 -0.00 0.00 -0.00 -0.00 -0.05 -0.03 -0.06 0.00 -0.02 0.01 -0.02 0.02 0.01 -0.01 0.00 0.00 -0.00 -0.00 0.01 -0.01 -0.05 0.03 0.07 -0.03 -0.07 -0.00 -0.01 -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.01 0.01 0.01 0.01 0.01 0.02 -0.04 0.16 -0.21 -0.00 -0.00 0.01 0.03 0.00 0.01 0.07 0.02 0.07 0.03 -0.50 0.59 -0.04 -0.04 0.25 0.11 -0.06 0.27 -0.01 0.10 -0.06 -0.03 0.04 0.05 0.18 0.13 0.08 0.02 0.00 -0.04 -0.00 -0.01 0.01 -0.08 0.04 0.08 -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 -0.01 -0.00 0.01 -0.00 -0.01 -0.00 -0.00 -0.00 -0.16 -0.06 -0.19 0.00 -0.07 0.01 -0.00 -0.00 0.01 0.45 0.25 0.53 0.04 -0.06 0.06 0.01 -0.07 0.02 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.03 0.20 -0.14 -0.07 0.03 0.07 0.06 0.06 0.06 0.00 0.01 0.01 0.02 -0.04 0.00 0.00 -0.01 -0.01 -0.19 -0.14 -0.20 -0.00 0.02 -0.03 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 -0.07 0.08 -0.09 0.07 0.13 0.01 -0.01 0.02 0.00 -0.02 0.01 0.18 0.12 0.16 -0.00 -0.23 0.03 -0.02 0.02 0.03 0.00 0.01 -0.01 0.08 -0.04 -0.08 -0.00 -0.00 0.00 0.00 -0.04 0.03 -0.00 0.00 0.00 -0.09 0.05 0.09 -0.05 -0.02 -0.01 0.00 0.00 -0.01 0.30 -0.13 -0.29 -0.01 -0.01 -0.01 -0.02 0.01 -0.03 0.00 -0.02 0.00 0.00 -0.01 -0.00 0.05 0.03 0.06 0.02 -0.05 0.03 0.01 0.03 -0.02 -0.03 0.01 0.01 -0.00 -0.01 0.00 -0.02 -0.10 0.07 0.01 -0.01 -0.01 -0.01 -0.01 -0.02 0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.01 0.01 0.04 0.03 0.04 0.00 -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 -0.01 -0.00 0.07 -0.08 0.02 -0.07 0.13 0.29 0.21 0.24 -0.00 0.00 0.01 -0.08 0.11 0.15 0.60 -0.02 0.33 -0.03 0.01 0.03 -0.00 0.00 -0.00 0.09 -0.05 -0.09 0.00 0.00 0.00 0.00 -0.01 0.01 -0.00 0.00 0.00 -0.01 0.01 0.02 -0.00 -0.00 -0.01 0.00 -0.00 -0.01 0.07 -0.03 -0.07 -0.01 -0.01 -0.01 0.01 -0.03 0.02 -0.00 0.03 -0.01 -0.01 0.01 -0.00 -0.01 -0.00 -0.01 -0.03 0.07 -0.05 -0.06 -0.15 0.15 -0.02 -0.02 0.00 -0.00 0.01 -0.01 0.07 0.49 -0.34 0.10 -0.02 -0.11 -0.06 -0.05 -0.06 0.01 0.00 -0.00 -0.01 0.01 -0.00 -0.01 0.01 0.02 0.17 0.12 0.19 -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 -0.11 0.10 0.13 0.08 0.07 0.04 -0.00 0.03 -0.01 0.49 -0.07 -0.14 0.29 0.14 0.14 -0.07 0.04 0.05 -0.00 -0.00 -0.00 0.18 -0.09 -0.17 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.05 -0.03 -0.06 0.02 -0.00 -0.00 0.00 0.00 0.01 -0.18 0.08 0.18 0.01 0.01 0.01 -0.07 -0.01 -0.09 0.01 -0.03 0.00 0.00 -0.01 0.00 0.18 0.11 0.22 0.03 -0.07 0.06 0.04 0.05 -0.07 0.01 -0.00 0.00 0.00 -0.00 0.00 -0.03 -0.17 0.12 -0.08 0.02 0.08 -0.11 -0.09 -0.14 0.02 0.01 0.01 0.00 0.00 0.00 -0.03 0.03 0.05 0.35 0.24 0.37 -0.01 0.01 -0.03 0.00 -0.00 -0.00 0.01 0.00 0.00 0.02 0.01 0.02 0.00 -0.05 0.06 0.07 -0.01 -0.23 -0.22 -0.18 -0.16 -0.01 0.08 -0.04 -0.14 0.06 0.10 -0.23 0.10 -0.13 -0.14 0.06 0.12 -0.01 0.10 -0.10 0.38 -0.19 -0.36 -0.00 -0.01 0.00 0.02 -0.31 0.29 -0.01 0.00 0.00 0.03 -0.01 -0.03 0.02 -0.00 -0.01 0.00 0.01 0.01 -0.08 0.03 0.08 0.00 0.00 0.00 0.00 0.01 0.01 0.01 0.00 -0.01 0.00 0.00 0.00 -0.02 -0.02 -0.03 0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.01 -0.01 0.01 -0.00 -0.00 -0.00 0.00 0.02 -0.01 -0.01 0.01 0.01 0.06 0.05 0.08 0.01 -0.01 -0.01 0.01 -0.02 -0.01 0.01 -0.02 -0.04 -0.18 -0.12 -0.19 -0.01 0.02 -0.03 0.01 -0.01 -0.01 0.01 -0.00 0.00 0.03 0.01 0.03 0.00 -0.06 0.07 0.10 -0.00 -0.36 -0.11 -0.11 -0.07 -0.04 0.02 0.07 0.05 0.01 0.01 0.24 0.26 0.10 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 -0.03 0.03 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.02 -0.03 -0.01 0.00 0.01 -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 -0.01 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 0.01 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 -0.02 -0.01 -0.02 -0.00 -0.00 0.00 -0.30 0.07 0.94 -0.01 0.05 -0.07 -0.00 0.01 0.00 -0.00 -0.01 -0.01 -0.05 0.06 -0.03 -0.07 0.03 0.06 0.01 -0.11 0.11 0.19 -0.10 -0.18 -0.00 0.01 -0.01 -0.02 0.32 -0.30 -0.00 0.01 -0.00 0.01 0.00 -0.01 0.01 -0.00 -0.01 -0.01 -0.01 -0.02 -0.02 0.01 0.02 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.00 0.00 0.00 -0.00 -0.01 -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 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.02 0.02 0.03 0.00 -0.00 -0.01 0.01 -0.01 -0.00 -0.00 -0.01 -0.01 -0.07 -0.05 -0.07 0.00 -0.01 0.02 0.01 0.00 -0.01 0.01 0.00 -0.01 -0.02 -0.01 -0.02 -0.00 0.04 -0.04 -0.25 0.08 0.72 -0.02 0.04 -0.09 0.04 0.01 -0.09 0.02 0.01 0.02 0.15 0.19 0.06 0.01 -0.00 -0.01 0.00 0.00 -0.00 -0.01 0.01 0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.01 0.01 -0.00 -0.00 -0.00 0.01 -0.00 -0.02 0.01 0.02 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.04 0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.09 -0.14 0.06 -0.05 -0.04 -0.04 -0.00 0.00 0.00 0.05 0.04 0.06 0.86 0.19 0.43 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.02 -0.02 0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.01 0.01 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 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.53 0.79 -0.23 -0.02 -0.02 -0.02 0.00 -0.00 -0.00 -0.02 0.00 0.01 0.14 0.09 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 0.01 -0.01 -0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.02 0.00 0.01 -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 -0.01 -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 0.02 -0.01 0.66 0.55 0.51 -0.00 0.00 0.00 -0.03 -0.01 -0.01 0.03 0.02 0.01 -0.00 0.00 0.00 0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -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 -0.50 0.42 0.75 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 -0.03 -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 -0.00 -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 -0.01 0.02 -0.01 0.02 0.02 0.01 0.00 -0.00 -0.00 0.92 0.24 0.28 -0.07 -0.03 -0.03 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.02 0.02 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.74 -0.50 -0.45 -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 0.01 -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 -0.01 -0.01 -0.00 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.05 0.03 -0.44 0.10 0.89 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.02 0.02 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.80 -0.60 -0.03 0.01 0.05 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.02 -0.02 -0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.79 0.59 0.18 0.00 0.00 0.00 -0.02 -0.01 -0.01 0.00 -0.01 0.00 -0.01 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -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 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.02 0.01 0.00 0.00 -0.00 -0.00 0.87 0.30 0.39 0.00 -0.00 0.00 0.00 -0.00 -0.00 42 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 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 42 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 42 16 16 16 16 1 1 1 1 1 97.90550 97.90550 31.97207 31.97207 31.97207 31.97207 97.90550 31.97207 31.97207 31.97207 31.97207 97.90550 31.97207 31.97207 31.97207 31.97207 97.90550 31.97207 31.97207 31.97207 31.97207 97.90550 31.97207 31.97207 31.97207 31.97207 97.90550 31.97207 31.97207 31.97207 31.97207 1.00783 1.00783 1.00783 1.00783 1.00783 1457.70735 0.99966 0.02596 -0.00201 -0.02596 0.99966 0.00237 0.00207 -0.00232 1.0 asymmetric 1 0.00184 0.00181 0.00104 0.03833 0.03771 0.02172 227922.7 43.23 47.39 49.27 59.48 62.27 72.95 84.15 92.43 95.31 97.49 103.90 105.94 112.24 120.94 124.50 128.72 132.11 136.22 141.21 143.82 148.94 153.30 154.92 159.78 161.66 164.93 170.16 170.67 172.59 177.59 180.29 188.03 191.30 192.13 205.98 212.36 223.12 227.78 228.20 235.49 240.94 246.93 249.61 251.51 257.15 267.15 275.56 283.03 283.57 285.42 290.75 300.71 307.31 320.95 333.84 338.75 346.15 357.78 376.03 382.97 393.68 400.81 406.69 429.17 434.21 443.82 451.01 471.84 482.93 497.79 531.87 534.71 540.48 549.44 557.18 578.85 606.75 613.40 648.97 683.78 713.88 729.38 738.09 746.30 756.35 760.27 769.55 775.51 780.11 793.50 801.33 805.08 860.93 894.30 946.15 969.29 997.75 3627.25 3833.72 3852.48 3872.14 3875.92 0.086811 0.140504 0.141448 -0.005092 -10035.949474 -10035.895781 -10035.894837 -10036.041377 88.167 170.277 308.420 0.000 0.000 0.000 0.889 2.981 47.705 0.889 2.981 40.456 86.390 164.315 220.259 1 0.594 1.984 5.827 2 0.594 1.983 5.644 3 0.594 1.983 5.567 4 0.594 1.981 5.194 5 0.595 1.980 5.103 6 0.595 1.977 4.790 7 0.596 1.974 4.508 8 0.597 1.971 4.322 9 0.598 1.970 4.262 10 0.598 1.970 4.217 11 0.598 1.967 4.092 12 0.599 1.966 4.054 13 0.599 1.964 3.940 14 0.601 1.960 3.794 15 0.601 1.959 3.737 16 0.602 1.957 3.672 17 0.602 1.955 3.621 18 0.603 1.953 3.561 19 0.604 1.950 3.491 20 0.604 1.949 3.455 21 0.605 1.946 3.387 22 0.605 1.944 3.331 23 0.606 1.943 3.310 24 0.607 1.940 3.250 25 0.607 1.939 3.228 26 0.608 1.937 3.189 27 0.608 1.934 3.129 28 0.609 1.934 3.123 29 0.609 1.933 3.101 30 0.610 1.929 3.046 31 0.610 1.928 3.017 32 0.612 1.923 2.936 33 0.613 1.920 2.903 34 0.613 1.920 2.894 35 0.616 1.910 2.761 36 0.617 1.905 2.703 37 0.620 1.897 2.609 38 0.621 1.893 2.570 39 0.621 1.893 2.566 40 0.623 1.887 2.507 41 0.624 1.883 2.464 42 0.626 1.877 2.418 43 0.627 1.875 2.397 44 0.627 1.873 2.383 45 0.629 1.868 2.342 46 0.632 1.859 2.271 47 0.634 1.852 2.213 48 0.636 1.844 2.164 49 0.636 1.844 2.160 50 0.637 1.842 2.148 51 0.639 1.837 2.114 52 0.642 1.827 2.052 53 0.644 1.820 2.013 54 0.649 1.806 1.934 55 0.653 1.792 1.863 56 0.655 1.787 1.837 57 0.658 1.778 1.799 58 0.662 1.765 1.740 59 0.669 1.743 1.653 60 0.672 1.735 1.621 61 0.676 1.722 1.573 62 0.679 1.713 1.542 63 0.682 1.706 1.517 64 0.691 1.677 1.427 65 0.694 1.670 1.407 66 0.698 1.658 1.371 67 0.701 1.648 1.344 68 0.711 1.620 1.270 69 0.717 1.604 1.233 70 0.724 1.583 1.184 71 0.742 1.535 1.081 72 0.743 1.530 1.073 73 0.746 1.522 1.057 74 0.751 1.509 1.032 75 0.756 1.497 1.011 76 0.768 1.465 0.954 77 0.784 1.423 0.886 78 0.788 1.413 0.871 79 0.810 1.359 0.793 80 0.832 1.305 0.723 81 0.852 1.259 0.668 82 0.862 1.235 0.641 83 0.868 1.221 0.626 84 0.874 1.209 0.613 85 0.881 1.193 0.597 86 0.883 1.187 0.591 87 0.890 1.173 0.576 88 0.894 1.164 0.567 89 0.897 1.157 0.561 90 0.907 1.136 0.541 91 0.912 1.124 0.530 92 0.915 1.119 0.525 93 0.956 1.035 0.452 0.219934e+03 2.342292 5.393327 0.187335e+43 42.272618 97.336300 0.649118e-15 -15.187677 -34.970918 1 0.689155e+01 0.838317 1.930296 2 0.628523e+01 0.798321 1.838202 3 0.604435e+01 0.781350 1.799125 4 0.500472e+01 0.699380 1.610381 5 0.477913e+01 0.679349 1.564259 6 0.407686e+01 0.610326 1.405328 7 0.353138e+01 0.547944 1.261688 8 0.321280e+01 0.506883 1.167142 9 0.311497e+01 0.493453 1.136218 10 0.304475e+01 0.483551 1.113417 11 0.285506e+01 0.455615 1.049092 12 0.279948e+01 0.447078 1.029435 13 0.264063e+01 0.421708 0.971018 14 0.244855e+01 0.388909 0.895497 15 0.237753e+01 0.376127 0.866064 16 0.229839e+01 0.361424 0.832211 17 0.223853e+01 0.349963 0.805821 18 0.216985e+01 0.336430 0.774659 19 0.209181e+01 0.320522 0.738030 20 0.205309e+01 0.312408 0.719347 21 0.198110e+01 0.296907 0.683654 22 0.192359e+01 0.284113 0.654194 23 0.190312e+01 0.279466 0.643495 24 0.184387e+01 0.265730 0.611867 25 0.182194e+01 0.260535 0.599904 26 0.178488e+01 0.251610 0.579354 27 0.172864e+01 0.237705 0.547335 28 0.172332e+01 0.236366 0.544252 29 0.170363e+01 0.231374 0.532759 30 0.165426e+01 0.218605 0.503356 31 0.162880e+01 0.211869 0.487845 32 0.155971e+01 0.193044 0.444499 33 0.153211e+01 0.185289 0.426643 34 0.152531e+01 0.183358 0.422197 35 0.141910e+01 0.152013 0.350022 36 0.137472e+01 0.138215 0.318252 37 0.130561e+01 0.115814 0.266672 38 0.127761e+01 0.106399 0.244993 39 0.127515e+01 0.105561 0.243064 40 0.123374e+01 0.091224 0.210051 41 0.120441e+01 0.080776 0.185993 42 0.117359e+01 0.069515 0.160064 43 0.116026e+01 0.064556 0.148645 44 0.115100e+01 0.061074 0.140628 45 0.112427e+01 0.050871 0.117135 46 0.107958e+01 0.033254 0.076570 47 0.104439e+01 0.018862 0.043432 48 0.101487e+01 0.006410 0.014759 49 0.101279e+01 0.005520 0.012711 50 0.100575e+01 0.002490 0.005733 51 0.985910e+00 -0.006163 -0.014190 52 0.950679e+00 -0.021966 -0.050579 53 0.928525e+00 -0.032206 -0.074158 54 0.885583e+00 -0.052771 -0.121509 55 0.848085e+00 -0.071561 -0.164775 56 0.834536e+00 -0.078555 -0.180879 57 0.814794e+00 -0.088952 -0.204820 58 0.785362e+00 -0.104930 -0.241611 59 0.742668e+00 -0.129205 -0.297506 60 0.727476e+00 -0.138181 -0.318174 61 0.705002e+00 -0.151810 -0.349555 62 0.690670e+00 -0.160729 -0.370093 63 0.679209e+00 -0.167997 -0.386826 64 0.638179e+00 -0.195057 -0.449136 65 0.629525e+00 -0.200987 -0.462789 66 0.613543e+00 -0.212155 -0.488506 67 0.602013e+00 -0.220394 -0.507476 68 0.570466e+00 -0.243770 -0.561301 69 0.554720e+00 -0.255926 -0.589292 70 0.534653e+00 -0.271928 -0.626137 71 0.492603e+00 -0.307503 -0.708051 72 0.489330e+00 -0.310398 -0.714717 73 0.482764e+00 -0.316265 -0.728227 74 0.472838e+00 -0.325288 -0.749002 75 0.464497e+00 -0.333017 -0.766800 76 0.442266e+00 -0.354316 -0.815843 77 0.415825e+00 -0.381089 -0.877491 78 0.409857e+00 -0.387367 -0.891946 79 0.379860e+00 -0.420377 -0.967954 80 0.353339e+00 -0.451808 -1.040326 81 0.332369e+00 -0.478380 -1.101510 82 0.322196e+00 -0.491879 -1.132594 83 0.316663e+00 -0.499403 -1.149918 84 0.311556e+00 -0.506464 -1.166176 85 0.305443e+00 -0.515069 -1.185991 86 0.303108e+00 -0.518403 -1.193667 87 0.297651e+00 -0.526293 -1.211834 88 0.294213e+00 -0.531338 -1.223452 89 0.291598e+00 -0.535215 -1.232379 90 0.284135e+00 -0.546475 -1.258304 91 0.279884e+00 -0.553021 -1.273379 92 0.277878e+00 -0.556145 -1.280572 93 0.249956e+00 -0.602137 -1.386472 0.552904e+25 24.742649 56.972056 1 0.740966e+01 0.869798 2.002785 2 0.680508e+01 0.832833 1.917670 3 0.656500e+01 0.817235 1.881752 4 0.552963e+01 0.742696 1.710121 5 0.530522e+01 0.724703 1.668691 6 0.460741e+01 0.663457 1.527666 7 0.406660e+01 0.609231 1.402807 8 0.375147e+01 0.574202 1.322148 9 0.365484e+01 0.562868 1.296052 10 0.358553e+01 0.554553 1.276905 11 0.339851e+01 0.531288 1.223336 12 0.334378e+01 0.524238 1.207103 13 0.318755e+01 0.503457 1.159253 14 0.299908e+01 0.476988 1.098306 15 0.292954e+01 0.466800 1.074846 16 0.285215e+01 0.455173 1.048073 17 0.279369e+01 0.446179 1.027364 18 0.272672e+01 0.435640 1.003098 19 0.265074e+01 0.423367 0.974838 20 0.261310e+01 0.417156 0.960537 21 0.254323e+01 0.405385 0.933433 22 0.248751e+01 0.395765 0.911283 23 0.246771e+01 0.392293 0.903289 24 0.241046e+01 0.382100 0.879817 25 0.238931e+01 0.378272 0.871003 26 0.235359e+01 0.371732 0.855944 27 0.229950e+01 0.361633 0.832691 28 0.229439e+01 0.360667 0.830466 29 0.227548e+01 0.357074 0.822192 30 0.222817e+01 0.347949 0.801183 31 0.220382e+01 0.343176 0.790192 32 0.213789e+01 0.329986 0.759820 33 0.211163e+01 0.324618 0.747460 34 0.210517e+01 0.323287 0.744396 35 0.200461e+01 0.302029 0.695448 36 0.196283e+01 0.292882 0.674386 37 0.189808e+01 0.278314 0.640842 38 0.187197e+01 0.272298 0.626990 39 0.186967e+01 0.271766 0.625764 40 0.183121e+01 0.262738 0.604976 41 0.180407e+01 0.256255 0.590048 42 0.177566e+01 0.249359 0.574171 43 0.176341e+01 0.246353 0.567249 44 0.175491e+01 0.244254 0.562416 45 0.173044e+01 0.238157 0.548376 46 0.168974e+01 0.227821 0.524577 47 0.165791e+01 0.219560 0.505556 48 0.163135e+01 0.212548 0.489409 49 0.162949e+01 0.212052 0.488267 50 0.162318e+01 0.210366 0.484387 51 0.160545e+01 0.205597 0.473404 52 0.157415e+01 0.197045 0.453713 53 0.155459e+01 0.191616 0.441211 54 0.151698e+01 0.180981 0.416725 55 0.148450e+01 0.171581 0.395081 56 0.147286e+01 0.168161 0.387204 57 0.145598e+01 0.163154 0.375676 58 0.143102e+01 0.155645 0.358386 59 0.139530e+01 0.144666 0.333107 60 0.138274e+01 0.140739 0.324064 61 0.136431e+01 0.134912 0.310647 62 0.135266e+01 0.131188 0.302071 63 0.134340e+01 0.128206 0.295204 64 0.131072e+01 0.117511 0.270579 65 0.130393e+01 0.115254 0.265382 66 0.129148e+01 0.111086 0.255786 67 0.128257e+01 0.108082 0.248868 68 0.125857e+01 0.099878 0.229978 69 0.124680e+01 0.095798 0.220582 70 0.123202e+01 0.090618 0.208656 71 0.120190e+01 0.079867 0.183900 72 0.119960e+01 0.079037 0.181991 73 0.119503e+01 0.077377 0.178168 74 0.118817e+01 0.074878 0.172413 75 0.118246e+01 0.072788 0.167601 76 0.116753e+01 0.067269 0.154893 77 0.115032e+01 0.060817 0.140036 78 0.114652e+01 0.059380 0.136728 79 0.112793e+01 0.052281 0.120382 80 0.111225e+01 0.046202 0.106384 81 0.110039e+01 0.041547 0.095665 82 0.109482e+01 0.039343 0.090590 83 0.109184e+01 0.038159 0.087865 84 0.108912e+01 0.037077 0.085374 85 0.108591e+01 0.035796 0.082422 86 0.108470e+01 0.035310 0.081304 87 0.108189e+01 0.034183 0.078710 88 0.108014e+01 0.033480 0.077090 89 0.107882e+01 0.032948 0.075865 90 0.107509e+01 0.031446 0.072408 91 0.107301e+01 0.030602 0.070464 92 0.107203e+01 0.030206 0.069552 93 0.105900e+01 0.024895 0.057322 0.100000e+01 0.000000 0.000000 0.218756e+10 9.339959 21.506051 0.154885e+09 8.190009 18.858193 Checking optimization ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] -4.4061 0.8930 1.5868 4.7675 -527.9900 -559.7876 -491.3109 -3.3796 -0.3293 0.2833 -1.6272 -33.4247 35.0519 -3.3796 -0.3293 0.2833 -71.0171 31.4033 5.5089 3.3064 -42.6129 0.7592 -20.9297 21.5116 0.5296 -5.3081 -25741.7716 -26206.5893 -4639.3179 -59.7294 25.5443 -97.2330 -80.4293 39.1221 -0.7169 -8628.0005 -5031.1009 -5022.6581 -133.0647 29.8466 12.7311 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|Beta|Orbitals: (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(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 -10036.0362848 0. 0. 0. 2.307E-9 1.7E-5 0.0868112 0.1405037 -10035.8957811 -10035.8948369 -10036.0413771 -25.0186822,-1.0356981,26.0543802,-1.4520553,0.6801955,-0.027146 C01 [X(H5Mo7S24)] -0.0515888 -1.7624128 0.6398761 1.6249082 -0.1393699 -0.0640198 -0.2205551 1.3917119 -0.1140942 -0.0757929 0.3706374 0.2258541 1.3361935 -0.0878487 0.1526252 -0.2239825 1.7541086 0.0076537 -0.142723 0.4396954 0.6721188 -0.052122 -0.082159 0.0499563 -0.0440304 -0.4544775 0.1924258 0.0671049 0.2347736 -0.2094018 -0.9395573 0.4226691 0.0631736 0.4688274 -0.4245141 -0.0833159 0.1393856 -0.0954831 -0.0739434 -0.7218977 -0.3446705 -0.4548898 -0.1511963 -0.1161303 -0.136905 -0.582664 -0.3582133 -0.4515048 -0.2402216 -0.1588927 0.0665767 -0.2131895 -0.4703135 0.3180766 0.0078971 0.1999499 -0.2390428 1.7206337 -0.2674431 -0.1465064 -0.5548187 1.6777595 -0.1371282 0.3072326 -0.5869193 0.9219159 -0.746721 0.3694735 -0.0178441 0.3723401 -1.0461378 0.0575977 -0.0504121 0.0436138 -0.172888 -0.2980223 -0.0797183 -0.069653 -0.036091 -0.2506941 0.0911717 -0.1753086 0.18233 -0.1873168 0.0026471 -0.0988609 0.0712176 0.0159769 -0.8256618 0.3181472 -0.0897903 0.7926946 -0.3737632 -0.5383432 0.2902021 0.2274425 0.2355533 -0.3457689 -0.2142256 0.3592907 -0.3236724 -0.2602156 1.4947188 0.4015426 -0.0820876 0.2570658 1.3370311 0.1647406 -0.4749716 -0.2299038 0.9246491 -1.0087659 -0.3455641 0.0822885 -0.1889701 -0.5886557 0.0192664 0.1214905 -0.0638067 -0.1267939 -0.1321321 0.1011006 0.1416253 0.0275502 -0.4746977 0.0167941 0.2861923 -0.0070665 -0.1890984 -0.299475 0.227426 0.2720235 0.3006357 -0.278046 -0.2890639 0.5999219 -0.2802238 -0.525007 -0.7488465 -0.2993787 -0.3143972 -0.3480944 -0.3574631 -0.1079439 -0.4529348 -0.09527 -0.2764597 1.3765016 -0.0237164 0.0645996 -0.073883 1.2583493 -0.2304489 -0.5351237 -0.3263517 0.9695008 -0.4170769 0.0927324 0.0065054 0.0926284 -0.1526404 -0.133121 0.0167881 -0.101665 -0.1497467 -1.0475433 0.1244996 -0.0422571 0.2632038 -0.1981745 -0.1098078 0.016062 -0.0984735 -0.3169386 -0.7457311 -0.1359356 -0.3303528 -0.0176259 0.0271731 -0.0604949 -0.4396999 -0.1506083 -0.2832587 -0.0742356 -0.0147374 0.0736059 -0.1517136 -0.6873931 0.379518 0.3557745 0.6246512 -0.5017849 1.5984726 -0.0064011 -0.1831898 0.2269308 1.3391381 -0.0410062 0.3501394 0.1695599 0.8019566 -0.7883869 0.0943468 0.0258252 0.0220662 -0.7472796 0.0206862 -0.0895154 0.0088731 -0.1780534 -0.5867231 -0.4649982 -0.0330013 -0.4611938 -0.5395531 0.1448584 -0.10445 0.1988423 -0.2844772 -0.2540024 -0.1914802 0.1359917 -0.214811 -0.5689205 0.3732059 0.0251824 0.5450604 -0.4115449 -0.3118727 0.39188 0.236113 0.304401 -0.4588505 -0.320053 0.2471549 -0.6141061 -0.3878127 1.0579877 -0.3942492 0.1215717 -0.1693582 1.6631556 0.1868454 0.4249004 -0.2402344 0.9447312 -0.4498924 -0.1014335 -0.0067053 -0.1464906 -0.8104947 -0.0442648 0.0746508 -0.0854016 -0.0822638 -0.1891345 0.1848826 0.1167183 0.2392663 -0.9960942 0.0763797 0.1364919 0.1703848 -0.2337721 -0.4349092 0.2204996 0.2435087 0.2907468 -0.8114037 -0.3758302 0.3475518 -0.4598298 -0.4159677 -0.5916489 -0.0037227 -0.3947674 -0.0860059 -0.0943852 -0.0573784 -0.6588918 0.1067409 -0.5393656 0.030227 -0.0458626 0.0097051 -0.0484557 0.0234215 -0.0172522 0.0414221 -0.0651711 0.0595324 0.2004708 0.2460413 0.0210105 0.164935 0.2025056 0.0524026 -0.0977048 0.067181 0.1323871 0.1122233 0.1106692 0.0098904 0.0656071 0.0764602 -0.0058487 0.096269 0.0082687 -0.0122513 0.0211782 0.0243141 -0.064433 0.0155545 0.0051143 -0.0075102 -0.0518275 0.0088998 0.1266111 0.041099 -0.0158366 0.0121297 -0.0128236 -0.058179 0.0659232 0.0009077 0.0102434 0.1034158 982.1601418|-8.529847|985.9149756|-9.9099342|-9.3206983|522.0017371 -0.000007545 0.000000203 0.000011702 -0.000022845 0.000002225 0.000020822 -0.000003907 0.000009308 0.000016155 0.000018026 -0.000007656 0.000009013 -0.000004680 -0.000002097 0.000021896 0.000013470 -0.000000627 0.000004374 -0.000013599 0.000000403 -0.000043097 0.000003695 0.000019549 0.000004453 0.000000910 -0.000007640 -0.000002862 -0.000005402 0.000006141 0.000020293 -0.000002560 0.000023631 -0.000009965 0.000006131 -0.000030694 -0.000059190 -0.000002266 -0.000020655 -0.000001183 -0.000022797 0.000010402 0.000006992 0.000000966 -0.000009834 0.000014197 -0.000006457 0.000015933 -0.000002219 0.000046524 -0.000060581 -0.000020996 0.000008884 0.000018663 0.000002237 -0.000008330 0.000007647 -0.000006687 -0.000005569 0.000025288 -0.000006013 -0.000009658 0.000002725 -0.000032244 -0.000018367 -0.000040592 -0.000005432 0.000022455 -0.000002050 0.000038042 0.000006042 0.000029933 -0.000015861 0.000014550 0.000008234 0.000011343 0.000003475 -0.000001291 0.000013050 0.000009133 -0.000019001 0.000043038 0.000004473 0.000012050 -0.000004509 -0.000003912 -0.000004523 0.000009358 -0.000007219 -0.000003420 -0.000002022 0.000001220 0.000003690 -0.000007521 0.000001957 0.000001424 -0.000013846 0.000011948 0.000006403 -0.000004854 -0.000016167 0.000008842 0.000014317 -0.000001815 0.000004133 -0.000005496 -0.000010762 -0.000006164 -0.000017285 1441.140000000001 AuxInfo=1/1/N:1;12;17;22;27;2;7;6;9;11;18;14;3;4;5;8;10;13;15;16;19;20;21;23;24;25;26;28;29;30;31/CRV:;;;;;;;;;;;1.1;;;;;;;;;;;;;;;;;;;/rA:36nMoMoS1SS1SMoS1SS1SMoS1S3S1S1MoSSS1S1MoS3SS1S1MoS3SS1S1HHHHH/rB:;s1;s2;s2;s2;;s1;s7;s7;s7;;s1;s12;s12;s12;s14;s7;s7s17;s17;s17;s4;s1s12s22;s12s22;s22;s22;;s1s2s27;s2s27;s27;s27;s9;s11;s6;s14;s18;/rC:.0121,.2614,-.7559;2.7669,2.5367,.3686;.4924,1.8434,-2.0775;1.0472,3.7534,1.1406;4.2876,2.8947,1.7839;3.1076,4.0242,-1.5235;.7026,-3.7887,-.0802;1.3386,-1.4905,-1.406;2.6461,-2.7271,1.3843;.329,-5.2918,1.3603;2.329,-4.7916,-1.3885;-3.6397,1.326,.1217;-1.9554,-.6163,-1.3627;-3.6474,-.903,1.5571;-4.5074,2.4678,1.6935;-5.2204,.4462,-1.0318;-2.7822,-2.834,.1529;-.4486,-2.0048,1.3182;-1.1888,-3.7862,-1.3845;-4.5418,-2.8489,-1.0352;-2.9372,-4.346,1.6563;-1.1378,3.8388,-.0554;-1.184,1.4626,1.0711;-2.8584,2.9006,-1.3964;-.3431,5.1893,-1.523;-2.2204,4.9674,1.3741;3.8307,-.7848,-.063;1.8151,.4572,1.0936;3.8772,1.1211,-1.3355;4.722,-2.2372,-1.3902;5.1763,-.4701,1.5602;3.5963,-3.6537,1.1345;2.8637,-3.6867,-1.9845;2.5261,5.1254,-.9984;-2.576,-.6585,2.3437;-.4697,-2.6064,2.5305;/R:/0/N:17,27,7,1,2,12,22,20,21,30,31,9,11,18,10,3,8,13,6,5,15,16,25,26,19,14,29,4,24,28,23/E:(8,9)(10,11)(12,13,14)(16,17,18)(21,22)(23,24)/CRV:8.1,9.1,10.1,11.1,15.1,16.1,17.1,18.1,20.1,21.1,22.1,23.1,24.1,26.3,30.3,31.3