* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/47/01/2009src0113.mol" Structure: 1 InChI=1/C16H17FN4O/c17-13-3-1-12(2-4-13)16(22)21-9-7-20(8-10-21)15-6-5-14(18)11-19-15/h1-6,11H,7-10,18H2 AuxInfo=1/0/N:23,30,25,28,4,6,9,18,12,15,1,22,27,3,8,21,39,33,32,36,37,38/E:(1,2)(3,4)(7,8)(9,10)/rA:39nCHCCHCHCCHHCHHCHHCHHCCCHCHCCHCHNNHHNNOF/rB:s1;d1;s3;s4;d4;s6;s6;;s9;s9;s9;s12;s12;;s15;s15;s15;s18;s18;;s21;s22;s23;d23;s25;s25;d27;s28;d22s28;s30;s1d8;s3;s33;s33;s8s9s18;s12s15s21;d21;s27;/rC:-3.5022,6.3366,1.918;-3.9776,7.1094,2.2003;-4.2304,5.3029,1.3549;-3.5178,4.1755,.9858;-3.9696,3.4308,.6057;-2.1398,4.1322,1.1719;-1.6466,3.3577,.9306;-1.4936,5.2383,1.7177;.6829,4.1446,1.5079;.3968,3.8292,.6151;.5118,3.4178,2.1593;2.1739,4.4649,1.4826;2.6858,3.6387,1.2949;2.3604,5.1135,.7587;1.8055,6.191,3.1672;1.9769,6.9379,2.541;2.0851,6.481,4.071;.3284,5.8768,3.1782;.1362,5.2214,3.8943;-.1834,6.7019,3.3707;3.6134,4.5571,3.5063;4.5801,3.5982,2.8785;4.8819,2.3983,3.5142;4.4227,2.1583,4.3107;5.8495,1.5468,2.9937;6.0493,.7194,3.4148;6.5098,1.9374,1.8454;6.259,3.1194,1.1987;6.7435,3.3667,.418;5.2689,3.9439,1.7255;5.0604,4.7606,1.2855;-2.1748,6.3208,2.0931;-5.609,5.4288,1.1388;-6.0235,6.1724,1.3612;-6.0606,4.7645,.7792;-.0962,5.3265,1.8817;2.602,5.0247,2.7618;3.8073,4.9438,4.6735;7.4621,1.1095,1.3161;