@MOLECULE (nitroamino)acetic acid 12 11 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.7931 -0.4848 -0.1158 O.3 1 UNL111111111 -0.5467 2 O -1.4613 1.2878 -0.4309 O.2 1 UNL111111111 -0.4821 3 O 2.5356 0.7686 0.0599 O.2 1 UNL111111111 -0.3740 4 O 1.6093 -0.9793 -0.8570 O.2 1 UNL111111111 -0.3959 5 N 0.6611 -0.0066 0.9112 N.pl3 1 UNL111111111 -0.4966 6 N 1.6598 -0.0641 -0.0599 N.pl3 1 UNL111111111 0.7555 7 C -0.5851 -0.7223 0.6325 C.3 1 UNL111111111 -0.1745 8 C -1.6108 0.1645 -0.0350 C.2 1 UNL111111111 0.5984 9 H -0.9779 -1.1100 1.6102 H 1 UNL111111111 0.2025 10 H -0.4049 -1.6395 0.0090 H 1 UNL111111111 0.2192 11 H 0.5475 0.9352 1.3186 H 1 UNL111111111 0.3277 12 H -3.5101 0.0415 -0.5572 H 1 UNL111111111 0.3665 @BOND 1 1 8 1 2 1 12 1 3 2 8 2 4 3 6 2 5 4 6 2 6 5 6 1 7 5 7 1 8 5 11 1 9 7 8 1 10 7 9 1 11 7 10 1