@MOLECULE (4s)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid 21 21 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.2031 -0.0651 -0.0020 S.3 1 UNL111111111 -0.0970 2 O 2.3261 -0.9708 -0.1688 O.3 1 UNL111111111 -0.5630 3 OXT 2.5867 1.2181 0.1428 O.2 1 UNL111111111 -0.4828 4 N -0.1501 1.6108 0.0764 N.3 1 UNL111111111 -0.5465 5 C -0.4761 -0.8033 0.0508 C.3 1 UNL111111111 0.1045 6 CA 0.3910 0.3600 -0.5031 C.3 1 UNL111111111 -0.0590 7 C -1.6023 1.6813 -0.1234 C.3 1 UNL111111111 -0.1412 8 C -0.4232 -2.0181 -0.8577 C.3 1 UNL111111111 -0.4739 9 C -0.1280 -1.1616 1.4849 C.3 1 UNL111111111 -0.4669 10 C 1.8537 0.3013 -0.1094 C.2 1 UNL111111111 0.6282 11 HA 0.3625 0.3455 -1.6309 H 1 UNL111111111 0.1577 12 H 0.3470 2.4412 -0.2442 H 1 UNL111111111 0.2869 13 H -2.0374 2.2935 0.6967 H 1 UNL111111111 0.1701 14 H -1.9178 2.1104 -1.0935 H 1 UNL111111111 0.1342 15 H -1.0523 -2.8387 -0.4860 H 1 UNL111111111 0.1622 16 H -0.7433 -1.8080 -1.8860 H 1 UNL111111111 0.1570 17 H 0.6038 -2.4152 -0.9155 H 1 UNL111111111 0.1743 18 H -0.0651 -0.2690 2.1277 H 1 UNL111111111 0.1748 19 H -0.8656 -1.8354 1.9393 H 1 UNL111111111 0.1589 20 H 0.8438 -1.6726 1.5463 H 1 UNL111111111 0.1634 21 H 3.2894 -1.0414 0.0515 H 1 UNL111111111 0.3582 @BOND 1 1 5 1 2 1 7 1 3 2 10 1 4 2 21 1 5 3 10 2 6 4 6 1 7 4 7 1 8 4 12 1 9 5 6 1 10 5 8 1 11 5 9 1 12 6 10 1 13 6 11 1 14 7 13 1 15 7 14 1 16 8 15 1 17 8 16 1 18 8 17 1 19 9 18 1 20 9 19 1 21 9 20 1