* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/08/81/01/02SRC193.mol" Structure: 1 InChI=1/C27H33O9P.C4H6O2.Cd.2ClH/c1-28-16-10-19(31-4)25(20(11-16)32-5)37(26-21(33-6)12-17(29-2)13-22(26)34-7)27-23(35-8)14-18(30-3)15-24(27)36-9;1-3-4(2,5-3)6-3;;;/h10-15H,1-9H3;1-2H3;;2*1H/q;;+1;;/p-1/t;3-,4?;;; AuxInfo=1/1/N:50,58,70,45,62,21,39,30,66,54,37,19,34,16,25,43,28,29,49,57,56,36,14,18,15,44,27,13,8,10,5,7,12,11,9,6,2;78,75,79,76,74,77;1;3;4/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);(1,2)(3,4)(5,6);;;/rA:79nCdPClClOOOOOOOOOCCCHCCHCHHHCHCCCCHHHCHCCHCHHHCCCHHHCCHHHCHCCCHHHCHHHCHHHCHHHOCCOCC/rB:s1;s1;s1;;;;;;;;;;s9;s2;s14;s16;s6;;s19;s12;s21;s21;s21;d18;s25;s2d14s18;s8s19;s10d16s25;s9;s30;s30;s30;d28;s34;s11s34;;s37;s11;s39;s39;s39;s13s37;s2d36;s5;s45;s45;s45;s5d15;s13;s50;s50;s50;d43s49;s54;s12d19s44;s7s15d37;s8;s58;s58;s58;s7;s62;s62;s62;s6;s66;s66;s66;s10;s70;s70;s70;;;s74s75;s76;;s74s76s77s78;/rC:24.4095,1.7422,1.375;26.4393,.8973,2.629;23.2534,4.0052,1.1217;22.6279,.1364,1.8818;27.0563,3.4111,1.6843;26.1487,-.7762,.5117;28.9141,-.8741,1.9091;27.447,3.9688,7.6202;26.2002,-.9525,5.1208;25.362,-4.9641,2.5536;24.5648,2.7661,3.9101;28.6364,.5756,4.545;31.3577,2.5689,-.2222;26.084,-1.6182,3.9633;27.9817,1.3003,1.7755;25.834,-2.9951,3.9171;25.813,-3.4988,4.7223;26.03,-1.6109,1.5908;28.0129,2.2494,6.1281;28.785,2.0839,6.6563;29.5749,.0028,5.4625;30.2334,.6807,5.7219;30.0327,-.7502,5.0339;29.1008,-.3139,6.2595;25.769,-2.9324,1.525;25.6908,-3.3748,.688;26.2097,-.9169,2.8043;27.105,3.2369,6.5164;25.6188,-3.6226,2.7116;26.1653,-1.6591,6.3394;25.2944,-2.0976,6.438;26.3029,-1.0355,7.0828;26.8742,-2.3358,6.3452;25.8893,3.4175,5.8235;25.2396,4.0478,6.1117;25.6886,2.6194,4.6876;30.1352,.8779,.7463;30.8213,.2756,.4835;23.3477,3.1768,4.571;23.2347,2.6617,5.397;22.5839,3.0157,3.9785;23.3988,4.1316,4.7858;30.2072,2.2102,.4399;26.6657,1.7007,4.2273;26.9616,4.6934,1.0355;27.5128,5.3448,1.5175;26.028,4.9916,1.036;27.2795,4.6164,.1117;28.1144,2.6221,1.3714;31.546,3.9365,-.5229;30.9058,4.2105,-1.2125;32.4589,4.0761,-.8507;31.4039,4.4714,.2858;29.2245,3.0987,.7017;29.2936,4.0087,.4378;27.8013,1.5327,5.0131;29.0312,.4393,1.4509;26.4864,4.9519,8.0709;26.2934,5.578,7.3422;26.8555,5.443,8.8345;25.6596,4.5006,8.3415;29.6864,-1.8601,1.2646;29.5662,-1.787,.2948;29.3982,-2.7478,1.5635;30.6321,-1.7315,1.4872;25.9944,-1.3795,-.7992;26.6427,-2.1071,-.9023;26.1501,-.7027,-1.4906;25.086,-1.7361,-.8898;25.0841,-5.7537,3.7141;25.8712,-5.7649,4.2978;24.8664,-6.6696,3.4416;24.3242,-5.3675,4.1977;30.3483,-5.904,2.6159;30.7375,-8.1073,3.7643;29.9242,-6.8906,3.4836;28.709,-6.0557,4.2407;29.8235,-3.877,4.2315;29.563,-5.1765,3.526;