* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/06/34/01/2009src0067p21c.mol"
Structure: 1
InChI=1/C10H14N4O/c1-9(15)13-5-7-14(8-6-13)10-11-3-2-4-12-10/h2-4H,5-8H2,1H3
AuxInfo=1/0/N:21,3,1,5,11,14,8,17,20,7,25,26,28,27,29/E:(3,4)(5,6)(7,8)(11,12)/rA:29nCHCHCHCCHHCHHCHHCHHCCHHHNNNNO/rB:s1;d1;s3;s3;s5;;;s8;s8;s8;s11;s11;;s14;s14;s14;s17;s17;;s20;s21;s21;s21;s1d7;d5s7;s7s8s17;s11s14s20;d20;/rC:-.4446,10.5991,5.8631;-.7173,11.0713,6.6406;-1.1556,10.7922,4.6924;-1.9055,11.374,4.6485;-.7117,10.0904,3.5949;-1.1799,10.1956,2.7748;.9618,9.1472,4.8176;2.5241,7.5678,3.723;3.446,7.8636,3.5181;1.9578,7.7565,2.9337;2.5193,6.075,4.0095;1.5846,5.7538,4.0791;2.9565,5.5929,3.2633;2.7218,6.5404,6.4023;3.2751,6.3455,7.1994;1.7902,6.2663,6.5969;2.7664,8.0357,6.0963;2.3717,8.5438,6.8486;3.706,8.3265,5.9837;4.2887,4.9548,5.2754;4.9615,4.7023,6.6017;5.5735,3.9423,6.518;4.2824,4.5018,7.2794;5.4644,5.4995,6.8699;.6034,9.7853,5.9536;.3395,9.2704,3.6187;2.0184,8.3024,4.8758;3.2275,5.7928,5.2556;4.7038,4.417,4.2425;