@MOLECULE (3s)-3-amino-2-butanone 15 14 0 0 0 SMALL GASTEIGER @ATOM 1 N 1.4542 0.9494 -0.6380 N.3 1 UNL111111111 -0.6384 2 C 0.6766 -0.2825 -0.4121 C.3 1 UNL111111111 -0.0330 3 C -0.7336 0.1223 0.0381 C.2 1 UNL111111111 0.4826 4 O -0.8910 0.9796 0.8687 O.2 1 UNL111111111 -0.4531 5 C 1.2536 -1.2064 0.6701 C.3 1 UNL111111111 -0.4924 6 C -1.8746 -0.6126 -0.5898 C.3 1 UNL111111111 -0.5513 7 H 2.4438 0.7668 -0.6759 H 1 UNL111111111 0.2529 8 H 1.2728 1.6409 0.0787 H 1 UNL111111111 0.2672 9 H 0.6371 -0.8231 -1.3940 H 1 UNL111111111 0.1564 10 H 2.2544 -1.5600 0.3994 H 1 UNL111111111 0.1547 11 H 1.3328 -0.6911 1.6364 H 1 UNL111111111 0.1641 12 H 0.6274 -2.0925 0.8227 H 1 UNL111111111 0.1546 13 H -2.8205 -0.4113 -0.0630 H 1 UNL111111111 0.1827 14 H -2.0150 -0.2904 -1.6331 H 1 UNL111111111 0.1830 15 H -1.7184 -1.6982 -0.5949 H 1 UNL111111111 0.1700 @BOND 1 1 2 1 2 1 7 1 3 1 8 1 4 2 3 1 5 2 5 1 6 2 9 1 7 3 4 2 8 3 6 1 9 5 10 1 10 5 11 1 11 5 12 1 12 6 13 1 13 6 14 1 14 6 15 1