* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/07/41/01/99SRC104.mol" Structure: 1 InChI=1/C25H30O7/c1-24(2)16-11-21(29-6)20(28-5)10-15(16)23-25(32-24)13-31-22(17(25)12-30-23)14-7-8-18(26-3)19(9-14)27-4/h7-11,17,22-23H,12-13H2,1-6H3/t17-,22-,23-,25-/m1/s1 AuxInfo=1/0/N:31,32,19,21,26,28,7,24,15,23,10,27,30,25,11,17,18,13,8,14,12,20,16,29,22,2,3,1,4,6,9,5/E:(1,2)/it:im/rA:62nOOOOOOCCOCCCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;s3;;;;s4s10;s2d8;s1d12;s8;s6s11;d10s11;;s2;s9s18;s3;s5s16s18;d11s14;d7s13;s7d15s20;s1;s6s18;s4;s5s17;s9s22;s29;s29;s27;s15;s21;s16;s7;s31;s31;s10;s30;s19;s18;s27;s21;s26;s19;s24;s28;s31;s30;s32;s28;s26;s23;s26;s21;s19;s32;s32;s20;s28;/rC:-.9462,1.9533,3.3495;1.2003,5.5692,-9.5513;-.6134,3.8061,-9.0263;-2.7776,.1893,2.8832;-1.2214,1.2086,-2.9627;.9856,2.6052,-1.4972;1.3132,5.6618,-5.8573;-.0019,4.3666,-7.9393;-1.4081,4.665,-3.905;-2.5148,.4111,.4667;-1.0436,2.1291,-.3451;-2.2144,.7586,1.7726;.9824,5.334,-8.226;-1.2601,1.7542,2.029;-.2995,4.0618,-6.6236;-.4135,2.9191,-1.4438;-1.8952,1.069,-.6102;.2329,2.9343,-3.7335;2.1976,6.5434,-9.8801;-.0067,4.3954,-4.1454;-1.5721,2.7807,-8.7732;-.951,2.596,-2.836;-.7225,2.4558,.9781;1.6377,5.9677,-7.1896;.36,4.7141,-5.5688;.0809,2.9025,3.6095;1.4629,2.7247,-2.8486;-3.9765,-.5651,2.7053;-2.161,.6092,-2.0312;-2.0581,3.5204,-3.3492;-3.5953,.8923,-2.4584;-1.8547,-.878,-2.1821;1.9932,1.8698,-3.0372;-.9365,3.3824,-6.4513;-1.8523,2.4972,-9.6781;-.5594,3.8919,-1.3115;1.7993,6.1319,-5.1063;-3.8159,1.8591,-2.369;-4.2284,.3672,-1.8929;-3.1328,-.3009,.298;-2.536,3.0366,-4.0888;1.9812,7.4153,-9.4795;.2398,2.3857,-4.5019;2.0944,3.4932,-2.9297;-1.1824,1.9967,-8.2629;.2216,2.8018,4.5334;2.2385,6.5041,-10.9225;2.3116,6.6942,-7.3885;-3.8019,-1.3226,2.2127;-3.7311,.6199,-3.3857;-2.6515,3.898,-2.6425;-.8981,-1.0285,-1.8943;-4.3213,-.7808,3.5879;.866,2.6263,3.1664;-.0376,3.1831,1.1683;-.1736,3.8675,3.3619;-2.332,3.1311,-8.2483;3.0347,6.2887,-9.4854;-2.3811,-1.4033,-1.4942;-1.981,-1.1425,-3.1357;.5274,4.9944,-3.5371;-4.6224,-.088,2.2038;