12 13 0 0000 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.3069 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.5689 -2.2603 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 3.5689 -4.4069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 4.3448 -3.3310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 2.3069 -2.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3069 -3.9982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1534 -2.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1534 -4.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.9982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1534 -0.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 2 12 2 0 3 5 1 0 3 6 2 0 4 5 1 0 4 7 2 0 6 7 1 0 6 8 1 0 7 9 1 0 8 10 2 0 8 12 1 0 9 11 2 0 10 11 1 0 M END > InChI=1S/C7H5N3O2/c11-7(12)4-2-1-3-5-6(4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10) > KFJDQPJLANOOOB-UHFFFAOYSA-N > 1/1/N:11,10,9,8,7,6,12,4,3,5,1,2/E:(11,12)/rA:12nOONNNCCCCCCC/rB:;;;s3s4;d3;d4s6;s6;s7;d8;d9s10;s1d2s8;/rC:;2.3069,0,0;3.5689,-2.2603,0;3.5689,-4.4069,0;4.3448,-3.331,0;2.3069,-2.6689,0;2.3069,-3.9982,0;1.1534,-2.0017,0;1.1534,-4.6655,0;0,-2.6689,0;0,-3.9982,0;1.1534,-.6672,0; > C7 H5 N3 O2 > 163.1335 > OC(C1=CC=CC2C1=NNN=2)=O > 4956805 $$$$