@MOLECULE 1,4-diamino-2-butanol 19 18 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.5165 1.8354 0.0057 O.3 1 UNL1111111111 -0.5650 2 N 2.2417 -1.4024 0.1693 N.3 1 UNL1111111111 -0.6418 3 N -3.0402 -0.6263 -0.1416 N.3 1 UNL1111111111 -0.6396 4 C 0.6343 0.4542 0.2712 C.3 1 UNL1111111111 0.1663 5 C -0.5437 -0.3221 -0.3146 C.3 1 UNL1111111111 -0.3882 6 C 1.9883 -0.0279 -0.3095 C.3 1 UNL1111111111 -0.1717 7 C -1.8511 0.0494 0.4074 C.3 1 UNL1111111111 -0.0950 8 H 0.6418 0.4277 1.3843 H 1 UNL1111111111 0.1440 9 H -0.6313 -0.1344 -1.3978 H 1 UNL1111111111 0.1407 10 H -0.3406 -1.4101 -0.2174 H 1 UNL1111111111 0.1768 11 H 1.9443 -0.0345 -1.4183 H 1 UNL1111111111 0.1415 12 H 2.7811 0.6965 -0.0242 H 1 UNL1111111111 0.1313 13 H -2.0190 1.1495 0.3589 H 1 UNL1111111111 0.1520 14 H -1.7813 -0.2031 1.4888 H 1 UNL1111111111 0.1437 15 H 0.3125 2.0051 -0.9330 H 1 UNL1111111111 0.3150 16 H 2.4601 -1.4231 1.1519 H 1 UNL1111111111 0.2492 17 H 2.9913 -1.8415 -0.3394 H 1 UNL1111111111 0.2517 18 H -2.9687 -1.6274 -0.0756 H 1 UNL1111111111 0.2458 19 H -3.2054 -0.3777 -1.1025 H 1 UNL1111111111 0.2433 @BOND 1 1 4 1 2 1 15 1 3 2 6 1 4 2 16 1 5 2 17 1 6 3 7 1 7 3 18 1 8 3 19 1 9 4 5 1 10 4 6 1 11 4 8 1 12 5 7 1 13 5 9 1 14 5 10 1 15 6 11 1 16 6 12 1 17 7 13 1 18 7 14 1