@MOLECULE (4r)-4-aminohexanoic acid 22 21 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.3735 -0.1725 0.0627 C.2 1 UNL1111111111 0.6454 2 O -3.3647 0.7504 0.1894 O.3 1 UNL1111111111 -0.5718 3 O -2.6213 -1.2972 -0.2789 O.2 1 UNL1111111111 -0.5005 4 C -1.0572 0.4477 0.4099 C.3 1 UNL1111111111 -0.3427 5 C 0.0798 -0.3565 -0.2199 C.3 1 UNL1111111111 -0.3336 6 C 1.4663 0.2160 0.1730 C.3 1 UNL1111111111 0.0687 7 C 2.5594 -0.8167 -0.1844 C.3 1 UNL1111111111 -0.2721 8 C 3.9074 -0.4187 0.4134 C.3 1 UNL1111111111 -0.4337 9 N 1.7649 1.5023 -0.4886 N.3 1 UNL1111111111 -0.6588 10 H -4.2662 0.4051 -0.0196 H 1 UNL1111111111 0.3576 11 H -0.9519 0.4816 1.5179 H 1 UNL1111111111 0.1827 12 H -1.0342 1.5102 0.0852 H 1 UNL1111111111 0.1773 13 H -0.0243 -0.3824 -1.3204 H 1 UNL1111111111 0.1530 14 H 0.0052 -1.4171 0.0983 H 1 UNL1111111111 0.1678 15 H 1.4905 0.4081 1.2775 H 1 UNL1111111111 0.1436 16 H 2.6466 -0.9169 -1.2822 H 1 UNL1111111111 0.1371 17 H 2.2656 -1.8160 0.1898 H 1 UNL1111111111 0.1393 18 H 4.7058 -1.0930 0.0889 H 1 UNL1111111111 0.1376 19 H 4.1846 0.6014 0.1098 H 1 UNL1111111111 0.1630 20 H 3.8828 -0.4294 1.5082 H 1 UNL1111111111 0.1409 21 H 1.9616 1.3949 -1.4691 H 1 UNL1111111111 0.2503 22 H 1.0241 2.1724 -0.3728 H 1 UNL1111111111 0.2488 @BOND 1 1 2 1 2 1 3 2 3 1 4 1 4 2 10 1 5 4 5 1 6 4 11 1 7 4 12 1 8 5 6 1 9 5 13 1 10 5 14 1 11 6 7 1 12 6 9 1 13 6 15 1 14 7 8 1 15 7 16 1 16 7 17 1 17 8 18 1 18 8 19 1 19 8 20 1 20 9 21 1 21 9 22 1