* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/01/01/2008src0886.mol"
Structure: 1
InChI=1/C39H32OP2.2C6Cl2F3.C3H8.2Au/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;2*7-4-2(9)1-3(10)5(8)6(4)11;1-3-2;;/h3-28H,1-2H3;;;3H2,1-2H3;;/q;;;;2*-1/p+2
AuxInfo=1/1/N:22,26,35,46,57,68,33,37,44,48,55,59,66,70,8,17,31,39,42,50,53,61,64,72,6,15,10,19,30,41,52,63,5,14,3,12,4,13,21,74,75,76;77,78,82,79,81,80,86,87,83,85,84;88,89,93,90,92,91,97,98,94,96,95;99,105,102;1;2/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)(41,42);2*(2,3)(4,5)(7,8)(9,10);(1,2);;/CRV:;2*1.3;;;/rA:108nAuAuCCCCHCHCHCCCCHCHCHCCHHHCHHHCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHOPPCCCCCCFFFClClCCCCCCFFFClClCHHCHHCHHH/rB:s1;;s3;d4;s5;s6;d6;s8;d3s8;s10;;d12;s13;d14;s15;s15;s17;s12d17;s19;s5s14;s21;s22;s22;s22;s21;s26;s26;s26;;d30;s31;s31;s33;d33;s35;s35;s37;s30d37;s39;;d41;s42;s42;s44;d44;s46;s46;s48;s41d48;s50;;s52;s53;d53;s55;s55;s57;d57;s59;d52s59;s61;;d63;s64;s64;s66;d66;s68;s68;s70;s63d70;s72;s4s13;s1s3s30s41;s2s12s52s63;s1;d77;s78;d79;s80;s77d81;s78;s80;s82;s79;s81;s2;d88;s89;d90;s91;s88d92;s89;s91;s93;s90;s92;;s99;s99;s99;s102;s102;s102;s105;s105;s105;/rC:14.2324,12.2028,11.158;15.6949,14.677,10.4582;15.8517,9.4312,10.1448;16.9352,9.6686,10.9972;17.5444,8.6577,11.7354;17.087,7.3541,11.5464;17.4943,6.6426,12.0264;16.0439,7.0763,10.6668;15.76,6.1792,10.5357;15.4182,8.109,9.9812;14.6928,7.9181,9.3983;17.9915,12.7572,12.5059;17.9179,11.3816,12.2791;18.4228,10.4435,13.172;18.8113,10.9091,14.431;19.1106,10.2901,15.0865;18.7668,12.2547,14.737;18.978,12.5463,15.6162;18.4148,13.185,13.7663;18.4622,14.1138,13.9604;18.6911,9.0356,12.6533;19.9919,9.1071,11.8029;20.1907,8.2208,11.4349;20.7364,9.4004,12.3687;19.868,9.7451,11.0694;18.892,8.0227,13.7759;18.0858,7.9872,14.332;19.6568,8.2923,14.3262;19.0625,7.1378,13.3909;13.5061,10.087,8.6212;13.5588,9.7477,7.2694;14.334,9.9521,6.7598;12.4875,9.1157,6.6695;12.527,8.8856,5.7487;11.3613,8.8187,7.4059;10.6312,8.3716,6.9941;11.2894,9.1688,8.7421;10.5092,8.9657,9.2446;12.3551,9.8161,9.3489;12.2977,10.0738,10.2615;15.9127,11.5052,8.084;15.4374,12.6401,7.425;14.7059,13.1269,7.7859;16.0302,13.0564,6.2475;15.6976,13.8247,5.7985;17.1054,12.3622,5.7171;17.5029,12.647,4.9026;17.6001,11.2454,6.384;18.3483,10.7786,6.0308;17.0097,10.8089,7.5592;17.3467,10.0416,8.0066;18.5664,15.4728,11.7743;17.8207,16.395,12.5011;16.9039,16.2233,12.6814;18.4079,17.566,12.9654;17.8918,18.1926,13.4588;19.7448,17.8198,12.7092;20.1498,18.6144,13.0364;20.4852,16.9186,11.9798;21.3986,17.1014,11.7932;19.9095,15.7448,11.5144;20.4313,15.1254,11.0177;18.9157,13.3719,9.8698;18.7191,13.8148,8.5581;17.9531,14.3321,8.3384;19.6476,13.4951,7.5805;19.5279,13.812,6.6929;20.744,12.7197,7.8897;21.3662,12.4908,7.2092;20.9466,12.2706,9.1865;21.7031,11.7342,9.3927;20.0404,12.6078,10.1808;20.1857,12.3183,11.0739;17.3786,10.9809,11.066;14.9354,10.8506,9.4666;17.7569,13.9598,11.1431;13.3335,13.2413,12.6879;11.9523,13.2641,12.7734;11.2421,13.9356,13.7487;11.9382,14.6214,14.7073;13.3242,14.6583,14.6892;13.9682,13.9702,13.6711;11.2248,12.5793,11.8497;11.2752,15.2822,15.6767;15.3283,14.0227,13.6735;9.5119,13.8944,13.7584;14.2001,15.5178,15.8925;14.021,15.8063,10.0133;12.8175,15.3438,9.5245;11.6913,16.1324,9.3272;11.7857,17.4753,9.6416;12.9614,18.0155,10.1028;14.0431,17.1664,10.2836;12.6922,14.0373,9.1942;10.7068,18.2734,9.4676;15.1901,17.7289,10.7332;10.2247,15.4673,8.7157;13.0792,19.7016,10.452;11.0453,9.0541,14.3611;10.2301,8.4923,14.3537;11.7018,8.6209,14.9623;11.6193,9.0907,12.9654;12.4699,9.597,12.9814;10.9912,9.5748,12.3727;11.8843,7.6787,12.3729;12.5126,7.1953,12.9491;12.2667,7.7677,11.475;11.0407,7.1826,12.321;