@MOLECULE (3r,4r)-3-hydroxy-4-methyl-d-proline 21 21 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.2800 1.8845 0.6528 O.3 1 UNL111111111 -0.5609 2 O 2.1064 1.0813 -0.7069 O.3 1 UNL111111111 -0.6090 3 OXT 2.2459 -1.1085 -0.3401 O.2 1 UNL111111111 -0.4457 4 N -0.0018 -0.9764 1.3847 N.3 1 UNL111111111 -0.5001 5 C -1.7115 -0.2602 -0.2220 C.3 1 UNL111111111 -0.1533 6 C -0.6584 0.8650 -0.0970 C.3 1 UNL111111111 0.1272 7 CA 0.4990 0.2653 0.7679 C.3 1 UNL111111111 -0.0844 8 C -1.0765 -1.4811 0.4938 C.3 1 UNL111111111 -0.1283 9 C -2.0506 -0.5652 -1.6730 C.3 1 UNL111111111 -0.4519 10 C 1.6826 -0.0793 -0.1119 C.2 1 UNL111111111 0.6210 11 H -2.6349 0.0618 0.3200 H 1 UNL111111111 0.1666 12 H -0.3143 1.2697 -1.0668 H 1 UNL111111111 0.1392 13 HA 0.8316 0.9998 1.5447 H 1 UNL111111111 0.1790 14 H -1.8184 -2.0677 1.0623 H 1 UNL111111111 0.1375 15 H -0.6028 -2.1750 -0.2363 H 1 UNL111111111 0.1612 16 H -0.3476 -0.8021 2.3268 H 1 UNL111111111 0.2644 17 H -1.1673 -0.8660 -2.2499 H 1 UNL111111111 0.1519 18 H -2.7806 -1.3811 -1.7473 H 1 UNL111111111 0.1517 19 H -2.4907 0.3069 -2.1732 H 1 UNL111111111 0.1526 20 H -0.8044 2.7337 0.5584 H 1 UNL111111111 0.3228 21 H 2.8946 0.9690 -1.2860 H 1 UNL111111111 0.3586 @BOND 1 1 6 1 2 1 20 1 3 2 10 1 4 2 21 1 5 3 10 2 6 4 7 1 7 4 8 1 8 4 16 1 9 5 6 1 10 5 8 1 11 5 9 1 12 5 11 1 13 6 7 1 14 6 12 1 15 7 10 1 16 7 13 1 17 8 14 1 18 8 15 1 19 9 17 1 20 9 18 1 21 9 19 1