* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/07/71/01/00src046.mol"
Structure: 1
InChI=1/C26H30O9/c1-14(27)34-25-18-11-23(32-6)22(31-5)10-17(18)24(16-7-8-20(29-3)21(9-16)30-4)19-12-33-13-26(19,25)35-15(2)28/h7-11,19,24-25H,12-13H2,1-6H3/t19-,24+,25+,26-/m1/s1
AuxInfo=1/0/N:57,62,10,14,49,44,23,25,20,53,41,31,34,56,61,22,55,40,29,18,19,48,43,27,38,37,7,9,1,2,5,4,3,6,8/it:im/rA:65nOOOOOOOOOCHHHCHHHCCCHCCHCHCHCHCHHCHHCCHCCHCCHHHCCHHHCHCCCHHHCCHHH/rB:;;;;;;;;s1;s10;s10;s10;s2;s14;s14;s14;s1;s2s18;d19;s20;s20;d22;s23;d18s23;s25;s22;s27;s27;s29;s3s29;s31;s31;s3;s34;s34;s8s29s34;s6s37;s38;s38;s40;s41;s4d41;s4;s44;s44;s44;s5s43;s5;s49;s49;s49;d48;s53;s27d40s53;s6d7;s56;s57;s57;s57;s8d9;s61;s62;s62;s62;/rC:1.8613,10.178,-2.7912;.2547,8.3945,-1.8146;4.6955,3.3615,-.5606;.9774,7.058,6.0868;1.7762,9.1706,4.8589;3.3582,3.2825,3.8229;2.3119,1.4622,3.0273;5.2805,4.3604,2.1336;5.827,2.2353,2.7226;2.6948,11.2136,-3.2849;3.0806,11.7091,-2.5326;2.1647,11.8229,-3.84;3.4151,10.8244,-3.8235;-.6275,7.4019,-1.3026;-.2578,6.5123,-1.4822;-1.5017,7.4863,-1.7373;-.7305,7.5238,-.3357;2.4123,9.333,-1.86;1.5324,8.3811,-1.3194;1.9718,7.5183,-.3286;1.3655,6.8947,.0534;3.3023,7.5544,.1177;4.1606,8.4746,-.4436;5.0653,8.5053,-.1553;3.7237,9.3636,-1.4295;4.3308,9.9907,-1.8045;3.7723,6.541,1.1461;4.7414,6.7083,1.3274;3.6323,5.1358,.5799;2.6768,5.014,.3113;4.4943,4.7898,-.6267;4.0341,5.0389,-1.4671;5.3609,5.2666,-.5847;4.0198,2.8531,.6049;4.5191,2.0934,.997;3.105,2.5511,.3769;3.9757,4.0246,1.5701;2.9207,4.0558,2.6788;2.0688,3.6661,2.3288;2.6524,5.4681,3.1742;1.9581,5.596,4.396;1.6966,4.8144,4.8685;1.6533,6.834,4.9149;.8606,5.9643,6.9848;.3071,5.2653,6.5781;.4429,6.2685,7.8175;1.7512,5.6042,7.1787;2.0664,7.9902,4.2322;2.3985,10.3389,4.3416;3.3589,10.1768,4.2331;2.2611,11.0844,4.9627;2.0045,10.5612,3.4722;2.7292,7.8731,3.0225;2.9911,8.6571,2.5543;3.0203,6.6102,2.4769;3.0195,1.9802,3.8486;3.6704,1.2892,4.9955;3.1734,.4721,5.2093;3.674,1.8828,5.7753;4.5923,1.0577,4.7569;6.0641,3.4051,2.7166;7.2768,4.0276,3.3262;7.702,3.3874,3.9343;7.0162,4.8293,3.8261;7.9079,4.2747,2.6184;