* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/08/79/01/02SRC311.mol"
Structure: 1
InChI=1/C36H24As3F3.C18H15B.C6H6.C5H6.4C2H3N.Fe/c40-34-22-10-7-19-31(34)37-25-13-1-2-14-26(25)38(32-20-8-11-23-35(32)41)29-17-5-6-18-30(29)39(28-16-4-3-15-27(28)37)33-21-9-12-24-36(33)42;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-5-3-1;1-2-4-5-3-1;4*1-2-3;/h1-24H;1-15H;1-6H;1-4H,5H2;4*1H3;
AuxInfo=1/0/N:24,26,66,64,44,46,14,37,54,16,35,56,22,28,68,62,42,48,12,39,52,18,33,58,21,30,70,61,41,50,11,31,51,20,32,60,92,93,94,95,96,97;107,129,140,105,109,127,131,138,142,103,111,125,133,136,144,102,124,135,146;113,114,122,116,120,118;5,7,3,9,1;71,75,98;76,80,99;81,85,100;86,90,101;91/E:(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);(1,2,3)(4,5,6,7,8,9)(10,11,12,13,14,15)(16,17,18);(1,2,3,4,5,6);(1,2)(3,4);;;;;/CRV:;;;1.3,3.3;;;;;/rA:146nCHCHCHCHCHCCHCHCHCHCCCHCHCHCHCCCCHCHCHCHCCHCHCHCHCCCHCHCHCHCCCHCHCHCHCCHHHCCHHHCCHHHCCHHHCFeAsAsAsFFFNNNNCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHB/rB:s1;s1;s3;s3;s5;s5;s7;s1d7;s9;;s11;s12;d12;s14;s14;s16;d16;s18;d11s18;;s21;s22;d22;s24;s24;s26;d26;s28;d21s28;;d31;s32;s33;d33;s35;s35;s37;s31d37;s39;;d41;s42;s42;s44;d44;s46;s46;s48;s41d48;;d51;s52;s52;s54;d54;s56;s56;s58;s51d58;;s61;s62;d62;s64;s64;s66;d66;s68;d61s68;;s71;s71;s71;s71;;s76;s76;s76;s76;;s81;s81;s81;s81;;s86;s86;s86;s86;s3s5;s11s21s70;s30s31s41;s50s51s61;s20;s32;s60;t75;t80;t85;t90;;s102;s103;d103;s105;s105;s107;d107;s109;d102s109;s111;;d113;s114;s114;s116;d116;s118;s118;s120;s113d120;s122;;s124;s125;d125;s127;s127;s129;d129;s131;d124s131;s133;;d135;s136;s136;s138;d138;s140;s140;s142;s135d142;s144;s102s124s135;/rC:1.031,2.7339,1.5265;.9614,3.0693,2.4126;.9748,1.3456,1.1536;.8709,.5593,1.6765;1.1435,1.5504,-.4225;1.1521,.8944,-1.1096;1.2607,2.787,-.5234;1.4019,3.2149,-1.3597;1.1825,3.4131,.5218;1.2356,4.3611,.552;3.0723,-1.1709,2.14;2.6977,-1.2622,3.4697;2.9816,-.5916,4.0797;1.9182,-2.3101,3.9294;1.6591,-2.3512,4.8425;1.5212,-3.2952,3.0462;.9875,-4.0186,3.3534;1.8935,-3.234,1.7294;1.6416,-3.9256,1.1287;2.6372,-2.1607,1.2808;5.231,-.2168,.1953;5.9738,-1.3827,.3372;5.8626,-1.929,1.1064;6.8732,-1.7427,-.6444;7.3845,-2.5384,-.5554;7.0297,-.9224,-1.7814;7.6342,-1.1814,-2.4669;6.3218,.2414,-1.9093;6.4582,.8033,-2.663;5.3891,.6016,-.9164;3.8581,2.5744,-2.7313;3.3798,1.6194,-3.5784;2.8493,1.8998,-4.822;2.494,1.2063,-5.3655;2.846,3.2178,-5.2617;2.5053,3.4366,-6.1211;3.3421,4.2033,-4.4379;3.3525,5.1045,-4.7386;3.8172,3.9037,-3.1999;4.1282,4.6044,-2.6389;5.6291,3.5529,-.4983;6.6822,3.9712,-1.3361;6.7747,3.5988,-2.2052;7.5715,4.9141,-.8971;8.2672,5.2044,-1.4751;7.4748,5.4527,.3762;8.112,6.09,.6768;6.4311,5.0497,1.2138;6.352,5.4262,2.0824;5.5178,4.1125,.791;3.4138,4.8623,2.8007;3.2237,6.0563,2.1337;3.5802,6.166,1.26;2.5095,7.1133,2.7287;2.369,7.9281,2.2609;2.0146,6.9387,4.0153;1.5479,7.6519,4.435;2.1858,5.7572,4.6924;1.8287,5.6434,5.5653;2.8952,4.7252,4.0738;5.1072,2.3552,3.1231;5.9012,2.9114,4.0988;5.9527,3.8542,4.2031;6.6341,2.0565,4.9371;7.1837,2.4228,5.6199;6.5618,.6871,4.7765;7.0607,.1206,5.3532;5.7683,.126,3.7815;5.733,-.8164,3.6669;5.0176,.9769,2.9458;4.1967,9.7394,4.8953;4.7323,9.3144,5.5973;3.7461,9.0492,4.3652;3.527,10.3257,5.3052;5.0618,10.5219,4.0344;8.7347,10.2093,5.5012;9.613,9.7979,5.6414;8.3066,9.8066,4.717;8.1745,10.0607,6.2915;8.9011,11.6677,5.2798;13.3884,2.466,3.1887;13.1715,2.8616,2.3187;12.5682,2.3659,3.7156;13.7997,1.5866,3.0543;14.3042,3.3203,3.8874;14.4383,6.295,1.7284;14.7388,5.8149,.9286;13.4611,6.2511,1.7878;14.8329,5.8821,2.5248;14.8531,7.672,1.646;2.7924,2.1059,.6669;3.9355,.3812,1.4851;4.3365,2.206,-.9436;4.1182,3.402,1.8704;2.7825,-2.0493,-.0022;3.1646,.4533,-3.1198;2.8986,3.6051,4.7216;5.7632,11.1503,3.3851;9.0231,12.7721,5.1349;15.0277,3.9747,4.433;15.2045,8.7454,1.5579;2.027,11.4437,8.1931;2.7867,10.329,8.6477;3.4872,10.4835,9.2706;2.5591,9.0544,8.2343;3.082,8.3459,8.5909;1.5643,8.7707,7.2896;1.4166,7.88,6.994;.8092,9.8029,6.8011;.1322,9.629,6.1577;1.0289,11.1187,7.2452;.4864,11.8157,6.8953;2.0433,13.1607,10.3244;1.9332,14.4588,10.8458;1.9666,15.1952,10.2467;1.7765,14.7115,12.2117;1.7226,15.6052,12.5294;1.6996,13.6428,13.1054;1.5896,13.8028,14.0353;1.7841,12.3624,12.6308;1.726,11.6272,13.2297;1.9579,12.1377,11.2475;2.0188,11.2416,10.9379;3.9392,13.2902,8.4332;4.7541,14.0305,9.2586;4.3826,14.387,10.057;6.1085,14.2864,8.9808;6.6217,14.8294,9.5675;6.6949,13.7392,7.8401;7.6193,13.8641,7.6601;5.9032,13.0158,6.9841;6.2802,12.6696,6.1838;4.5594,12.7774,7.2619;4.045,12.2597,6.6538;1.4025,14.0029,7.875;1.8371,14.8359,6.8325;2.7653,14.8532,6.6307;.9857,15.6392,6.0762;1.3291,16.1878,5.3808;-.3835,15.6227,6.3598;-.9815,16.1558,5.8491;-.8656,14.8294,7.3845;-1.7951,14.8143,7.5803;.0087,14.0621,8.1186;-.3432,13.5413,8.831;2.3436,12.9602,8.6973;