* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/10/39/01/97src237.mol"
Structure: 1
InChI=1/C19H10ClO2.C5H5.Fe/c20-13-6-8-15-17(10-13)19(22)14-7-5-12(9-16(14)18(15)21)11-3-1-2-4-11;1-2-4-5-3-1;/h1-10H;1-5H;
AuxInfo=1/0/N:11,12,10,13,16,27,17,28,20,25,14,15,26,18,22,19,23,21,24,2,3,4;5,6,9,7,8;1/E:(1,2)(3,4);(1,2,3,4,5);/CRV:4.3;1.3;/rA:43nFeClOOCCCCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHH/rB:;;;s1;s5;d6;s7;s5d8;;s10;d11;s1s12;d10s13;s14;d15;s16;d17;s18;s15d19;d3s19;s21;d22;d4s18s23;s23;s2d25;s26;s22d27;s5;s6;s7;s8;s9;s10;s11;s12;s13;s16;s17;s20;s25;s27;s28;/rC:1.4816,5.5958,13.4917;1.5484,1.6998,2.2009;2.0663,.982,8.8098;.3615,5.1587,5.8867;3.4295,6.0086,13.361;2.7278,6.6202,12.3057;1.7292,7.4974,12.9065;2.0268,7.4155,14.2295;2.9974,6.4684,14.5346;1.2439,3.6061,13.1836;.805,3.9217,14.5159;-.158,4.8976,14.4225;-.4139,5.1632,13.0559;.426,4.3118,12.2683;.5863,4.2617,10.8021;.1337,5.3575,10.055;.2126,5.312,8.6946;.6637,4.1691,8.0129;1.1087,3.1204,8.7569;1.0373,3.1735,10.1141;1.679,1.926,8.1031;1.6168,1.9184,6.5996;1.1292,2.9884,5.8524;.6873,4.2405,6.584;1.1482,2.8715,4.5014;1.6221,1.759,3.9162;2.1195,.7422,4.7193;2.1089,.7452,6.0672;4.1,5.3727,13.252;2.8736,6.4912,11.3967;1.0578,7.9877,12.4894;1.6183,7.9452,14.8739;3.2844,6.2089,15.3782;1.9441,3.0354,12.9594;1.1178,3.5347,15.3004;-.5741,5.315,15.1385;-1.0229,5.784,12.7259;-.2149,6.1057,10.4815;-.0395,6.0617,8.2059;1.3115,2.4283,10.5998;.83,3.5681,3.9753;2.4878,.0015,4.2928;2.4027,.0304,6.584;