@MOLECULE (3r,4r)-4-hydroxy-3-methyl-l-proline 21 21 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.0585 1.1581 -0.9576 N.3 1 UNL1111111111 -0.5030 2 CA -0.4609 -0.2119 -0.5608 C.3 1 UNL1111111111 -0.0425 3 C 0.6033 -0.7899 0.4178 C.3 1 UNL1111111111 -0.1353 4 C 1.6149 0.3664 0.6290 C.3 1 UNL1111111111 0.1142 5 C -1.7903 -0.0470 0.1605 C.2 1 UNL1111111111 0.6406 6 O 2.7564 0.0581 -0.1449 O.3 1 UNL1111111111 -0.5556 7 C 0.9166 1.6236 0.0570 C.3 1 UNL1111111111 -0.1749 8 C 1.2567 -2.0440 -0.1418 C.3 1 UNL1111111111 -0.4379 9 HA -0.5985 -0.8648 -1.4581 H 1 UNL1111111111 0.1726 10 H 0.1318 -1.0287 1.4020 H 1 UNL1111111111 0.1619 11 H 1.9204 0.4765 1.6859 H 1 UNL1111111111 0.1224 12 H 3.4596 0.7198 -0.0052 H 1 UNL1111111111 0.3126 13 H 1.6308 2.3439 -0.3778 H 1 UNL1111111111 0.1429 14 H 0.3470 2.1542 0.8532 H 1 UNL1111111111 0.1663 15 H 1.7188 -1.8606 -1.1223 H 1 UNL1111111111 0.1631 16 H 2.0674 -2.3914 0.5133 H 1 UNL1111111111 0.1594 17 H 0.5377 -2.8630 -0.2507 H 1 UNL1111111111 0.1442 18 H 0.3485 1.1604 -1.8913 H 1 UNL1111111111 0.2659 19 O -2.8068 -0.3751 -0.6758 O.3 1 UNL1111111111 -0.5590 20 OXT -2.0003 0.2818 1.2964 O.2 1 UNL1111111111 -0.5108 21 H -3.7043 -0.2410 -0.2857 H 1 UNL1111111111 0.3528 @BOND 1 1 2 1 2 1 18 1 3 2 3 1 4 2 5 1 5 2 9 1 6 3 8 1 7 3 10 1 8 4 3 1 9 4 11 1 10 5 19 1 11 5 20 2 12 6 4 1 13 6 12 1 14 7 1 1 15 7 4 1 16 7 13 1 17 7 14 1 18 8 15 1 19 8 16 1 20 8 17 1 21 19 21 1