* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/27/01/2008src1283.mol"
Structure: 1
InChI=1/C14H15N3O2/c18-14(12-4-3-11-19-12)17-9-7-16(8-10-17)13-5-1-2-6-15-13/h1-6,11H,7-10H2
AuxInfo=1/0/N:5,3,26,24,7,1,10,19,13,16,28,23,9,22,30,31,32,34,33/E:(7,8)(9,10)/rA:34nCHCHCHCHCCHHCHHCHHCHHCCCHCHCHNNNOO/rB:s1;s1;s3;d3;s5;s5;s7;d7;;s10;s10;s10;s13;s13;;s16;s16;s16;s19;s19;;s22;d23;s24;s24;s26;d26;s28;d1s9;s9s10s19;s13s16s22;s23s28;d22;/rC:4.2919,3.5584,15.1943;4.4639,4.3687,15.6587;3.5432,2.5955,15.8356;3.1991,2.7373,16.7103;3.3108,1.4092,15.1511;2.8041,.717,15.5589;3.8204,1.236,13.8717;3.6649,.4303,13.3929;4.5707,2.2798,13.2989;4.5478,1.2466,11.0634;3.7126,1.6568,10.7252;4.3118,.3931,11.5055;5.4835,.97,9.8975;6.2595,.4433,10.216;5.0089,.4333,9.2138;6.6551,3.0447,10.2909;6.9667,3.8846,9.8696;7.4481,2.5565,10.6278;5.7262,3.368,11.4467;6.225,3.8734,12.1367;4.9864,3.9402,11.1233;5.2859,2.6966,8.2097;5.7264,3.9438,7.5521;5.0707,4.6696,6.6073;4.1961,4.5053,6.2736;5.9406,5.7206,6.2141;5.7623,6.3985,5.5734;7.0738,5.5627,6.9335;7.8355,6.1266,6.869;4.7976,3.4254,13.9511;5.1728,2.148,12.0421;5.9561,2.2219,9.2949;6.9769,4.4816,7.769;4.3155,2.1072,7.7227;