@MOLECULE 1-methyl-3-nitro-1h-1,2,4-triazole 13 13 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.5490 0.7486 0.0004 O.2 1 UNL1111111111 -0.3257 2 O -2.0891 -1.3592 -0.0004 O.2 1 UNL1111111111 -0.3580 3 N 1.7788 -0.1162 0.0002 N.ar 1 UNL1111111111 -0.1054 4 N 0.6354 -0.8292 0.0003 N.ar 1 UNL1111111111 -0.1846 5 N 0.1596 1.4063 -0.0003 N.ar 1 UNL1111111111 -0.3211 6 N -1.7730 -0.1840 0.0000 N.pl3 1 UNL1111111111 0.6461 7 C -0.3534 0.1154 0.0000 C.ar 1 UNL1111111111 0.0827 8 C 1.4940 1.2541 -0.0002 C.ar 1 UNL1111111111 0.0617 9 C 3.0604 -0.8005 0.0000 C.3 1 UNL1111111111 -0.2345 10 H 2.2307 2.0400 -0.0004 H 1 UNL1111111111 0.2096 11 H 3.1564 -1.4547 0.8924 H 1 UNL1111111111 0.1824 12 H 3.1586 -1.4499 -0.8956 H 1 UNL1111111111 0.1823 13 H 3.8880 -0.0698 0.0031 H 1 UNL1111111111 0.1646 @BOND 1 1 6 2 2 2 6 2 3 3 4 ar 4 3 8 ar 5 3 9 1 6 4 7 ar 7 5 7 ar 8 5 8 ar 9 6 7 1 10 8 10 1 11 9 11 1 12 9 12 1 13 9 13 1