@MOLECULE (2S)-2-(3-chlorophenyl)-2-(methanesulfonamido)acetic acid 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 C -1.3984 0.4989 -1.9421 C.ar 1 UNL111111111 -0.1472 2 C -2.7472 0.2389 -2.1842 C.ar 1 UNL111111111 -0.1228 3 C -3.5685 -0.2326 -1.1615 C.ar 1 UNL111111111 -0.1632 4 C 3.7857 -0.2653 1.3190 C.3 1 UNL111111111 -0.7502 5 C -3.0067 -0.4317 0.0937 C.ar 1 UNL111111111 0.0209 6 C -1.6708 -0.1780 0.3668 C.ar 1 UNL111111111 -0.1781 7 C -0.8623 0.2934 -0.6705 C.ar 1 UNL111111111 -0.0158 8 C 0.5962 0.5873 -0.4126 C.3 1 UNL111111111 0.0258 9 N 1.2713 -0.5648 0.1853 N.3 1 UNL111111111 -0.8744 10 C 0.7074 1.7573 0.5717 C.2 1 UNL111111111 0.6261 11 O 1.4417 1.9033 1.5100 O.2 1 UNL111111111 -0.5077 12 S 2.9756 -0.8130 -0.1437 S.O2 1 UNL111111111 2.3854 13 O 3.2924 0.0751 -1.2383 O.2 1 UNL111111111 -0.9288 14 O 3.1098 -2.2436 -0.2671 O.2 1 UNL111111111 -0.9093 15 CL -3.9991 -1.0119 1.3586 Cl 1 UNL111111111 -0.0761 16 H -0.7679 0.8700 -2.7513 H 1 UNL111111111 0.1663 17 H -3.1622 0.4062 -3.1785 H 1 UNL111111111 0.1620 18 H -4.6231 -0.4367 -1.3475 H 1 UNL111111111 0.1758 19 H 3.1681 0.4501 1.8972 H 1 UNL111111111 0.2223 20 H 4.0245 -1.0933 2.0007 H 1 UNL111111111 0.1934 21 H 4.7260 0.2592 1.0982 H 1 UNL111111111 0.1931 22 H -1.2587 -0.3313 1.3664 H 1 UNL111111111 0.1831 23 H 1.1044 0.9274 -1.3721 H 1 UNL111111111 0.2015 24 H 0.6971 -1.4065 0.2121 H 1 UNL111111111 0.3185 25 O -0.1660 2.7283 0.2090 O.3 1 UNL111111111 -0.5582 26 H -0.1403 3.5280 0.7907 H 1 UNL111111111 0.3575 @BOND 1 1 7 ar 2 1 16 1 3 2 1 ar 4 2 17 1 5 3 2 ar 6 3 5 ar 7 3 18 1 8 4 19 1 9 4 20 1 10 4 21 1 11 5 6 ar 12 6 7 ar 13 6 22 1 14 7 8 1 15 8 10 1 16 8 23 1 17 9 8 1 18 9 12 1 19 9 24 1 20 10 25 1 21 11 10 2 22 12 13 2 23 12 4 1 24 14 12 2 25 15 5 1 26 25 26 1