@MOLECULE (2-{[(4-chlorophenyl)sulfonyl]amino}-2,3-dihydro-1h-inden-5-yl)acetic acid 40 42 0 0 0 SMALL GASTEIGER @ATOM 1 CL -5.7742 2.7866 0.1360 Cl 1 UNL111111111 -0.0817 2 S -2.0860 -2.2050 -0.1585 S.O2 1 UNL111111111 2.3714 3 O -2.1042 -2.8853 1.1114 O.2 1 UNL111111111 -0.9048 4 O -2.2498 -2.9158 -1.4037 O.2 1 UNL111111111 -0.8919 5 O 8.0052 0.3448 0.0487 O.3 1 UNL111111111 -0.5796 6 O 6.3637 1.4262 1.1023 O.2 1 UNL111111111 -0.4806 7 N -0.5980 -1.3473 -0.3155 N.3 1 UNL111111111 -0.9214 8 C -0.0461 -0.5232 0.7564 C.3 1 UNL111111111 0.1508 9 C 1.3273 -1.0779 1.2555 C.3 1 UNL111111111 -0.3303 10 C 0.2913 0.8848 0.1484 C.3 1 UNL111111111 -0.3190 11 C 2.3325 -0.3148 0.4587 C.ar 1 UNL111111111 -0.0083 12 C 1.7439 0.7953 -0.1793 C.ar 1 UNL111111111 -0.0108 13 C 3.6695 -0.6052 0.2774 C.ar 1 UNL111111111 -0.1840 14 C 2.4797 1.5951 -1.0329 C.ar 1 UNL111111111 -0.1652 15 C 4.4206 0.2166 -0.5744 C.ar 1 UNL111111111 0.0096 16 C 3.8323 1.2949 -1.2310 C.ar 1 UNL111111111 -0.1559 17 C -3.2103 -0.8469 -0.0777 C.ar 1 UNL111111111 -0.3858 18 C 5.8736 -0.0733 -0.7757 C.3 1 UNL111111111 -0.3530 19 C -3.7243 -0.3013 -1.2530 C.ar 1 UNL111111111 -0.0413 20 C -3.5152 -0.2910 1.1637 C.ar 1 UNL111111111 -0.0582 21 C 6.6932 0.6651 0.2354 C.2 1 UNL111111111 0.6493 22 C -4.5353 0.8325 -1.1930 C.ar 1 UNL111111111 -0.2038 23 C -4.3156 0.8464 1.2385 C.ar 1 UNL111111111 -0.2029 24 C -4.8018 1.3848 0.0533 C.ar 1 UNL111111111 0.0646 25 H -0.7639 -0.4271 1.6010 H 1 UNL111111111 0.1338 26 H 1.4072 -2.1714 1.1223 H 1 UNL111111111 0.1671 27 H 1.4585 -0.9004 2.3384 H 1 UNL111111111 0.1641 28 H 0.0973 1.6855 0.8824 H 1 UNL111111111 0.1562 29 H -0.3304 1.1060 -0.7352 H 1 UNL111111111 0.1672 30 H 0.0845 -1.6744 -0.9919 H 1 UNL111111111 0.3236 31 H 4.1286 -1.4480 0.7869 H 1 UNL111111111 0.1601 32 H 2.0241 2.4366 -1.5478 H 1 UNL111111111 0.1561 33 H 4.4251 1.9199 -1.8977 H 1 UNL111111111 0.1579 34 H 6.2107 0.1957 -1.8043 H 1 UNL111111111 0.1918 35 H 6.0853 -1.1673 -0.7008 H 1 UNL111111111 0.1925 36 H -3.4984 -0.7465 -2.2303 H 1 UNL111111111 0.1803 37 H -3.1371 -0.7431 2.0934 H 1 UNL111111111 0.1782 38 H -4.9396 1.2697 -2.1045 H 1 UNL111111111 0.1741 39 H -4.5521 1.2936 2.2030 H 1 UNL111111111 0.1740 40 H 8.6175 0.7773 0.6873 H 1 UNL111111111 0.3557 @BOND 1 1 24 1 2 2 3 2 3 2 4 2 4 2 7 1 5 2 17 1 6 5 21 1 7 5 40 1 8 6 21 2 9 7 8 1 10 7 30 1 11 8 9 1 12 8 10 1 13 8 25 1 14 9 11 1 15 9 26 1 16 9 27 1 17 10 12 1 18 10 28 1 19 10 29 1 20 11 12 ar 21 11 13 ar 22 12 14 ar 23 13 15 ar 24 13 31 1 25 14 16 ar 26 14 32 1 27 15 16 ar 28 15 18 1 29 16 33 1 30 17 19 ar 31 17 20 ar 32 18 21 1 33 18 34 1 34 18 35 1 35 19 22 ar 36 19 36 1 37 20 23 ar 38 20 37 1 39 22 24 ar 40 22 38 1 41 23 24 ar 42 23 39 1