31 32 0 0000 0 0 0 0 0999 V2000 11.0049 -7.8245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 10.3556 -6.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.0681 -6.7020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 8.4298 -5.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.0681 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.4298 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.1312 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.4929 -2.2340 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 7.1312 -1.1225 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 5.2053 -2.2340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 6.4929 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.1312 -5.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.0049 -5.5905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 10.3556 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.0049 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.3556 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.0681 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.4298 -1.1225 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 9.0681 0.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 5.8436 -1.1225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.4298 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.0681 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.8737 -6.7020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.2244 -5.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.8737 -4.4680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 3.2244 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.8737 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9369 -3.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.2876 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9369 -5.5905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 13 1 0 3 4 1 0 4 5 2 0 4 12 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 11 1 0 8 9 1 0 8 10 2 0 11 12 2 0 13 14 1 0 14 15 2 0 14 22 1 0 15 16 1 0 16 17 2 0 17 18 1 0 17 21 1 0 18 19 1 0 18 20 2 0 21 22 2 0 23 24 1 0 24 25 2 0 24 31 1 0 25 26 1 0 26 27 1 0 26 28 2 0 28 29 1 0 29 30 1 0 29 31 2 0 M CHG 4 8 1 9 -1 18 1 19 -1 M END > InChI=1S/C13H10N4O5.C6H8N2O/c18-13(14-9-1-5-11(6-2-9)16(19)20)15-10-3-7-12(8-4-10)17(21)22;1-4-3-5(2)8-6(9)7-4/h1-8H,(H2,14,15,18);3H,1-2H3,(H,7,8,9) > UKHWDRMMMYWSFL-UHFFFAOYSA-N > 1/1/N:5,12,15,22,6,11,16,21,4,14,7,17,2,3,13,8,18,1,9,10,19,20;27,30,28,26,29,24,25,31,23/E:(1,2,3,4)(5,6,7,8)(9,10)(11,12)(14,15)(16,17)(19,20,21,22);(1,2)(4,5)(7,8)/CRV:16.5,17.5;/rA:31nOCNCCCCN+O-OCCNCCCCN+O-OCCOCNCCCCCN/rB:d1;s2;s3;d4;s5;d6;s7;s8;d8;s7;s4d11;s2;s13;d14;s15;d16;s17;s18;d18;s17;s14d21;;s23;d24;s25;s26;d26;s28;s29;s24d29;/rC:11.0049,-7.8245,0;10.3556,-6.702,0;9.0681,-6.702,0;8.4298,-5.5905,0;9.0681,-4.468,0;8.4298,-3.3565,0;7.1312,-3.3565,0;6.4929,-2.234,0;7.1312,-1.1225,0;5.2053,-2.234,0;6.4929,-4.468,0;7.1312,-5.5905,0;11.0049,-5.5905,0;10.3556,-4.468,0;11.0049,-3.3565,0;10.3556,-2.234,0;9.0681,-2.234,0;8.4298,-1.1225,0;9.0681,0,0;5.8436,-1.1225,0;8.4298,-3.3565,0;9.0681,-4.468,0;3.8737,-6.702,0;3.2244,-5.5905,0;3.8737,-4.468,0;3.2244,-3.3565,0;3.8737,-2.234,0;1.9369,-3.3565,0;1.2876,-4.468,0;0,-4.468,0;1.9369,-5.5905,0; > C19 H18 N6 O6 > 426.3828 > O=C(NC1C=CC([N+](=O)[O-])=CC=1)NC1C=CC([N+](=O)[O-])=CC=1.OC1N=C(C)C=C(C)N=1 > 9135 $$$$