@MOLECULE 6-hydroxy-4-nitro-cyclohexa-2,4-dien-1-one 15 15 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.0314 0.8716 0.0117 O.2 1 UNL1111 -0.3845 2 N 2.3082 -0.1113 0.0032 N.pl3 1 UNL1111 0.6109 3 O 2.7213 -1.2598 0.0003 O.2 1 UNL1111 -0.3882 4 C 0.8678 0.0979 -0.0032 C.2 1 UNL1111 -0.0086 5 C 0.0182 -1.0081 -0.0008 C.2 1 UNL1111 -0.2438 6 C -1.3534 -0.7950 -0.0025 C.3 1 UNL1111 0.1386 7 O -2.2666 -1.7631 -0.0067 O.3 1 UNL1111 -0.3442 8 C 0.3726 1.4342 -0.0150 C.2 1 UNL1111 -0.1118 9 C -0.9684 1.6667 -0.0133 C.2 1 UNL1111 -0.2156 10 C -1.9441 0.5702 0.0019 C.2 1 UNL1111 0.3782 11 O -3.1411 0.7578 0.0198 O.2 1 UNL1111 -0.3361 12 H 0.4335 -2.0205 0.0026 H 1 UNL1111 0.1980 13 H -1.8567 -2.6763 -0.0076 H 1 UNL1111 0.3253 14 H 1.0934 2.2620 -0.0251 H 1 UNL1111 0.1953 15 H -1.3854 2.6742 -0.0211 H 1 UNL1111 0.1866 @BOND 1 1 2 2 2 2 3 2 3 2 4 1 4 4 5 2 5 4 8 1 6 5 6 1 7 5 12 1 8 6 7 1 9 6 10 1 10 7 13 1 11 8 9 2 12 8 14 1 13 9 10 1 14 9 15 1 15 10 11 2