@MOLECULE [2-oxo-3-(sulfanylmethyl)-1-piperidinyl]acetic acid 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.3655 -0.8984 0.5376 S.3 1 UNL1111111111 -0.2087 2 O -0.3375 -1.6114 -0.4844 O.2 1 UNL1111111111 -0.5739 3 O 2.8147 0.3784 -1.0141 O.3 1 UNL1111111111 -0.5399 4 O 4.1328 -0.9917 0.1461 O.2 1 UNL1111111111 -0.5037 5 N 0.6912 0.1001 0.5289 N.am 1 UNL1111111111 -0.4823 6 C -1.3604 0.5247 -0.8469 C.3 1 UNL1111111111 -0.1786 7 C -1.4908 1.8201 -0.0417 C.3 1 UNL1111111111 -0.2722 8 C -0.0996 2.4327 0.1240 C.3 1 UNL1111111111 -0.2978 9 C 0.7807 1.4992 0.9680 C.3 1 UNL1111111111 -0.0511 10 C -0.3163 -0.4122 -0.2617 C.2 1 UNL1111111111 0.5915 11 C -2.6893 -0.2057 -1.0194 C.3 1 UNL1111111111 -0.3085 12 C 1.8262 -0.7497 0.8518 C.3 1 UNL1111111111 -0.1365 13 C 3.0462 -0.4996 -0.0097 C.2 1 UNL1111111111 0.6085 14 H -0.9799 0.7892 -1.8769 H 1 UNL1111111111 0.1735 15 H -1.9473 1.6309 0.9516 H 1 UNL1111111111 0.1652 16 H -2.1737 2.5240 -0.5511 H 1 UNL1111111111 0.1470 17 H 0.3664 2.6095 -0.8655 H 1 UNL1111111111 0.1557 18 H -0.1625 3.4248 0.6087 H 1 UNL1111111111 0.1493 19 H 1.8410 1.8405 0.9165 H 1 UNL1111111111 0.1443 20 H 0.4647 1.5441 2.0384 H 1 UNL1111111111 0.1382 21 H -2.5726 -1.0286 -1.7565 H 1 UNL1111111111 0.1784 22 H -3.4597 0.4775 -1.4260 H 1 UNL1111111111 0.1674 23 H 1.5380 -1.8363 0.7305 H 1 UNL1111111111 0.2178 24 H 2.1123 -0.6283 1.9264 H 1 UNL1111111111 0.1760 25 H -2.4924 -1.9010 0.7326 H 1 UNL1111111111 0.1869 26 H 3.6013 0.5064 -1.6049 H 1 UNL1111111111 0.3536 @BOND 1 1 11 1 2 1 25 1 3 2 10 2 4 3 13 1 5 3 26 1 6 4 13 2 7 5 9 1 8 5 10 am 9 5 12 1 10 6 7 1 11 6 10 1 12 6 11 1 13 6 14 1 14 7 8 1 15 7 15 1 16 7 16 1 17 8 9 1 18 8 17 1 19 8 18 1 20 9 19 1 21 9 20 1 22 11 21 1 23 11 22 1 24 12 13 1 25 12 23 1 26 12 24 1