* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/12/01/2008src1007.mol" Structure: 1 InChI=1/C24H24N2S4.4C2H6/c1-3-5-7-15-9-11-27-21(15)23-25-17-13-20-18(14-19(17)29-23)26-24(30-20)22-16(8-6-4-2)10-12-28-22;4*1-2/h9-14H,3-8H2,1-2H3;4*1-2H3 AuxInfo=1/0/N:21,61,24,64,16,56,13,53,11,51,19,59,49,9,5,45,4,44,7,47,8,48,6,46,3,43,2,42,1,41;30,37;70,77;27,34;67,74/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);4*(1,2)/rA:80nSSNCCCCCCHCHCHHCHHCHCHHCHHCHHCHHHCHHCHHHSSNCCCCCCHCHCHHCHHCHCHHCHHCHHCHHHCHHCHHH/rB:;;s3;;s1d3;s1d4;s2d5s6;s7;s9;s5;s11;s5;s13;s13;s13;s16;s16;s2d11;s19;;s21;s21;s16s21;s24;s24;;s27;s27;;s30;s30;s30;s27;s34;s34;s30;s37;s37;s37;;;;d9s43;;s41d43;s41s44;s42d45s46;s4d47;s49;s45;s51;s45;s53;s53;s53;s56;s56;s42d51;s59;;s61;s61;s56s61;s64;s64;;s67;s67;;s70;s70;s70;s67;s74;s74;s70;s77;s77;s77;/rC:1.52,6.476,.521;.54,4.424,-3.227;.222,6.927,-1.691;.072,8.061,-.907;1.933,3.641,-1.189;.944,6.028,-1.08;.722,8.006,.357;1.228,4.735,-1.669;.661,9.044,1.274;1.099,8.989,2.115;1.896,2.566,-2.125;2.325,1.732,-1.975;2.626,3.571,.148;1.947,3.678,.86;3.254,4.333,.218;3.401,2.277,.404;2.793,1.504,.283;4.13,2.197,-.261;1.188,2.847,-3.253;1.07,2.237,-3.971;4.737,.924,2.098;5.308,.702,1.32;4.073,.197,2.2;3.994,2.233,1.805;3.267,2.346,2.467;4.622,2.991,1.913;5.647,.975,3.405;6.177,.142,3.48;6.273,1.74,3.351;4.733,1.128,4.634;5.281,1.171,5.445;4.127,.36,4.689;4.209,1.952,4.55;4.798,.618,3.608;3.883,.59,3.984;5.223,-.264,3.757;5.589,1.679,4.279;5.629,1.497,5.241;5.163,2.548,4.128;6.497,1.692,3.911;-1.52,11.755,-.521;-.54,13.807,3.227;-.222,11.304,1.691;-.072,10.17,.907;-1.933,14.59,1.189;-.944,12.203,1.08;-.722,10.225,-.357;-1.228,13.496,1.669;-.661,9.188,-1.274;-1.099,9.243,-2.115;-1.896,15.665,2.125;-2.325,16.5,1.975;-2.626,14.66,-.148;-1.947,14.553,-.86;-3.254,13.898,-.218;-3.401,15.955,-.404;-2.793,16.727,-.283;-4.13,16.035,.261;-1.188,15.384,3.253;-1.07,15.994,3.971;-4.737,17.307,-2.098;-5.308,17.53,-1.32;-4.073,18.034,-2.2;-3.994,15.998,-1.805;-3.267,15.885,-2.467;-4.622,15.24,-1.913;-5.647,17.256,-3.405;-6.177,18.089,-3.48;-6.273,16.491,-3.351;-4.733,17.103,-4.634;-5.281,17.06,-5.445;-4.127,17.871,-4.689;-4.209,16.279,-4.55;-4.798,17.614,-3.608;-3.883,17.642,-3.984;-5.223,18.496,-3.757;-5.589,16.553,-4.279;-5.629,16.734,-5.241;-5.163,15.683,-4.128;-6.497,16.54,-3.911;