* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/08/78/01/02SRC154.mol" Structure: 1 InChI=1/C33H26NO2P.BrH/c1-22-21-28(29-30(31(22)34)33(36)27-20-12-11-19-26(27)32(29)35)37(23-13-5-2-6-14-23,24-15-7-3-8-16-24)25-17-9-4-10-18-25;/h2-21,37H,34H2,1H3;1H AuxInfo=1/0/N:8,32,43,54,30,34,41,45,52,56,20,18,28,36,39,47,50,58,22,16,5,7,27,38,49,24,15,4,26,13,12,25,14,60,62,61,63;3/E:(2,3,4)(5,6,7,8,9,10)(13,14,15,16,17,18)(23,24,25);/rA:63nHHBrCCHCCHHHCCCCCHCHCHCHCCCCCHCHCHCHCHCCHCHCHCHCHCCHCHCHCHCHNOOP/rB:;;;s4;s5;d5;s7;s8;s8;s8;s7;d12;s13;s14;d15;s16;s16;s18;d18;s20;s20;s22;s15d22;s24;d4s13s25;;s27;s28;d28;s30;s30;s32;d32;s34;d27s34;s36;;s38;s39;d39;s41;s41;s43;d43;s45;d38s45;s47;;s49;s50;d50;s52;s52;s54;d54;s56;d49s56;s58;s1s2s12;d14;d25;s4s27s38s49;/rC:-1.3336,.939,-.2478;-2.1228,.1128,.4635;3.7317,1.611,.6109;.2577,2.5133,3.7049;-.6077,1.4139,3.7963;-.7921,1.0543,4.6561;-1.1997,.8336,2.7077;-2.1649,-.3177,2.8667;-2.2403,-.5521,3.8152;-1.8356,-1.0918,2.364;-3.0449,-.0559,2.5239;-.882,1.3046,1.4019;.0504,2.3824,1.2684;.486,2.8277,-.0604;1.4234,3.9875,-.1566;1.8855,4.3856,-1.4001;1.6192,3.915,-2.1812;2.7436,5.4808,-1.5003;3.0956,5.7307,-2.3466;3.0825,6.2019,-.3748;3.6427,6.9647,-.457;2.6153,5.8266,.8752;2.8498,6.3291,1.6466;1.7971,4.7027,.9872;1.3737,4.249,2.3091;.5617,2.9961,2.4231;.0307,4.6544,5.7944;.1076,5.1024,7.1051;.6536,4.6472,7.7353;-.6214,6.2238,7.4896;-.5745,6.5335,8.3865;-1.4016,6.8791,6.5865;-1.8932,7.6442,6.8613;-1.4887,6.4513,5.2851;-2.0256,6.9264,4.6619;-.7891,5.3215,4.8834;-.8682,5.0037,3.9916;2.711,3.3452,5.2663;3.3187,4.1437,6.2094;2.7886,4.6593,6.8058;4.6967,4.1973,6.291;5.1123,4.7643,6.93;5.476,3.4227,5.4393;6.4229,3.4394,5.5141;4.8695,2.6265,4.4813;5.4022,2.1048,3.8926;3.4952,2.5891,4.38;3.0804,2.054,3.7135;.5789,1.9071,6.5039;-.5912,1.9381,7.2325;-1.192,2.6678,7.1368;-.8912,.8977,8.1093;-1.7,.9114,8.6074;-.0069,-.1536,8.2506;-.2111,-.8626,8.849;1.1641,-.1845,7.5351;1.7684,-.9092,7.6453;1.4671,.8445,6.6488;2.2732,.8222,6.1466;-1.4654,.7394,.3446;.0995,2.3065,-1.0943;1.6392,4.8709,3.3256;.925,3.1763,5.2477;