* Input_File: "/usr/local/tomcat/temp/inchi24975/input.mol" Structure: 1 InChI=1/2C8H11O2PS2.2C6H6N.Cd/c2*1-9-7-3-5-8(6-4-7)11(12,13)10-2;2*1-6-2-4-7-5-3-6;/h2*3-6,11H,1-2H3;2*2-5H,1H2;/q2*-2;;;+4 AuxInfo=1/0/N:15,1,8,11,6,13,10,5,60,59,63,65,66;33,19,26,29,24,31,28,23,62,61,64,67,68;46,39,42,37,44,41,57;56,49,52,47,54,51,58;69/E:2*(3,4)(5,6)(12,13);2*(2,3)(4,5);/CRV:2*12-1,13-1;2*1d;/rA:71nCHHHCCHCHCCHCHCHHHCHHHCCHCHCCHCHCHHHCHCHCCHCHC.2CHCHCCHCHC.2N4N4OOOOPPSSSSCdHH/rB:s1;s1;s1;;s5;s6;d6;s8;s8;d10;s11;d5s11;s13;;s15;s15;s15;;s19;s19;s19;;d23;s24;s24;s26;d26;s28;s29;s23d29;s31;;s33;s33;s33;;s37;d37;s39;s39;d41;s42;s42;s44;s41;;s47;d47;s49;s49;d51;s52;s52;s54;s51;s37d44;s47d54;s1;s10s15;s19;s28s33;s5s59;s23s61;s63;s63;s64;s64;s57s58s65s66s67s68;s46;s56;/rC:.4634,15.1551,11.0281;.5691,16.0723,11.3497;-.4844,14.9072,11.0503;.7942,15.0977,10.1269;3.2428,13.0892,12.9906;2.3476,12.5442,13.8991;1.4748,12.9099,13.9814;2.7255,11.4735,14.6804;2.1076,11.0974,15.2833;4.0102,10.9528,14.5789;4.916,11.4931,13.6948;5.7968,11.1434,13.6308;4.5176,12.5517,12.905;5.1328,12.9155,12.2923;5.6113,9.3982,15.4204;5.8371,9.0417,14.5547;5.6781,8.6834,16.0734;6.2338,10.1192,15.6459;8.65,13.4269,10.112;8.1951,12.9282,10.8075;9.3654,12.8753,9.7403;8.006,13.6555,9.4244;9.4053,17.0953,11.5151;10.0224,17.794,10.4869;9.8261,17.5595,9.6065;10.909,18.8154,10.7409;11.3275,19.2748,10.0376;11.1936,19.1763,12.0332;10.5842,18.5017,13.0638;10.7712,18.7465,13.9435;9.6969,17.4633,12.7933;9.2842,16.9989,13.4967;12.2806,20.7398,13.4523;11.4211,21.0363,13.8103;12.8953,21.5015,13.4051;12.6618,20.0487,14.021;3.0421,19.0323,10.543;2.6477,18.7535,11.3438;2.5903,20.2019,9.9676;1.8977,20.7042,10.3718;3.1503,20.6414,8.7979;4.1278,19.8273,8.2341;4.5175,20.0638,7.4182;4.5229,18.6774,8.8711;5.1938,18.1397,8.4756;2.6864,21.8988,8.2065;5.4709,18.8325,13.6065;4.7855,18.3102,13.9979;5.9791,19.9021,14.301;5.6467,20.1019,15.1499;6.9833,20.687,13.7484;7.4356,20.3206,12.5058;8.1307,20.8148,12.096;6.8709,19.2391,11.8744;7.1862,19.0128,11.0256;7.5259,21.8873,14.3775;4.0097,18.2778,10.0208;5.8974,18.4937,12.4048;1.2182,14.252,11.8509;4.2765,9.9091,15.402;9.2165,14.6413,10.6496;12.0814,20.2037,12.1681;2.7903,14.5127,12.013;8.2163,15.8005,11.1288;3.0852,16.2275,12.9986;3.7296,14.5057,10.2921;7.0901,16.3677,9.5918;7.1316,15.2228,12.6511;5.0958,16.5781,11.2993;2.0152,22.3471,8.6825;8.1479,22.3706,13.8791;