* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/07/35/01/00SRC200.mol"
Structure: 1
InChI=1/2C15H13N2PS.Pt/c2*1-3-7-13(8-4-1)18(14-9-5-2-6-10-14)17-15-16-11-12-19-15;/h2*1-12H,(H,16,17);/q;;-2/p+2
AuxInfo=1/1/N:16,27,14,18,25,29,12,20,23,31,4,2,11,22,1,55,57,59,61;38,49,36,40,47,51,34,42,45,53,6,8,33,44,10,56,58,60,62;63/E:2*(1,2)(3,4,5,6)(7,8,9,10)(13,14);/rA:63nCCHCHCHCHCCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHN4N4NNPPSSPt/rB:;s2;d2;s4;;s6;d6;s8;;;d11;s12;s12;s14;d14;s16;s16;s18;s11d18;s20;;d22;s23;s23;s25;d25;s27;s27;s29;s22d29;s31;;d33;s34;s34;s36;d36;s38;s38;s40;s33d40;s42;;s44;s45;d45;s47;s47;s49;d49;s51;d44s51;s53;d1s4;s6d10;s1;s10;s11s22s57;s33s44s58;s1s2;s8s10;s55s56s59s60;/rC:2.4106,-.6923,5.4921;2.8492,1.062,3.794;3.0207,1.6078,3.0356;2.7817,1.5007,5.0565;2.9269,2.4121,5.2819;1.6031,3.699,7.3382;1.5,3.5182,6.4113;1.4995,4.9442,7.8316;1.3547,5.7266,7.3126;1.8652,3.1798,9.5268;1.0559,-2.6131,8.4911;-.0849,-2.9112,7.7331;-.1377,-2.6299,6.8273;-1.1302,-3.6103,8.2965;-1.8924,-3.8206,7.7698;-1.0828,-4.0072,9.6126;-1.8093,-4.488,9.9913;.0246,-3.7048,10.3833;.0525,-3.9664,11.2961;1.0945,-3.0206,9.827;1.8587,-2.8277,10.3575;3.9054,-2.3195,8.3321;4.0279,-3.6678,8.4658;3.2737,-4.2285,8.3273;5.2658,-4.2315,8.8079;5.3389,-5.1697,8.9379;6.3815,-3.4257,8.9566;7.2487,-3.8022,9.0505;6.2088,-2.1623,8.9636;6.9451,-1.6079,9.1937;4.9579,-1.5352,8.6415;4.8736,-.589,8.6461;.2912,.2704,10.9351;-.6981,-.1769,10.0655;-.5222,-.2077,9.1324;-1.9371,-.5784,10.5411;-2.6036,-.8896,9.9398;-2.193,-.5218,11.8964;-3.03,-.822,12.2308;-1.2465,-.0347,12.7658;-1.4459,.0304,13.6923;.0012,.3636,12.2983;.6532,.6974,12.9032;3.1623,.0901,11.3355;2.9643,-1.0546,12.1122;2.1009,-1.4469,12.1682;4.0317,-1.6203,12.804;3.8951,-2.3951,13.3366;5.2817,-1.059,12.7169;6.0109,-1.4572,13.1777;5.4862,.0801,11.9642;6.3519,.4685,11.9156;4.4366,.6525,11.2846;4.5818,1.4406,10.7744;2.4892,.5512,6.0078;1.8669,2.6986,8.2471;2.2485,-1.828,6.1496;1.9721,2.463,10.6254;2.3433,-1.5809,7.7982;1.8861,.833,10.2965;2.5775,-.6484,3.7469;1.6691,4.9101,9.5556;2.1587,.6423,8.0783;