@MOLECULE 2,6-dichloro-4-[3-(4-methyl-1-piperazinyl)propyl]-n-(1,3,5-trimethyl-1h-pyrazol-4-yl)benzenesulfonamide 59 61 0 0 0 SMALL GASTEIGER @ATOM 1 C -6.8162 1.5923 0.0827 C.3 1 UNL111111111 -0.1627 2 C -7.8944 1.0889 1.0758 C.3 1 UNL111111111 -0.1172 3 N -8.2871 -0.3193 0.8773 N.3 1 UNL111111111 -0.3916 4 C -9.1170 -0.5082 -0.3293 C.3 1 UNL111111111 -0.2828 5 C -7.0777 -1.1645 0.8615 C.3 1 UNL111111111 -0.1187 6 C -5.9993 -0.6941 -0.1455 C.3 1 UNL111111111 -0.1614 7 N -5.6282 0.7078 0.1648 N.3 1 UNL111111111 -0.4177 8 C -4.5536 1.1893 -0.7393 C.3 1 UNL111111111 -0.1176 9 C -3.2115 0.6177 -0.2454 C.3 1 UNL111111111 -0.2635 10 C -2.0514 1.1802 -1.0803 C.3 1 UNL111111111 -0.3099 11 C -0.7883 0.4943 -0.6692 C.ar 1 UNL111111111 0.1156 12 C -0.4245 -0.7186 -1.2588 C.ar 1 UNL111111111 -0.2652 13 C 0.7216 -1.3728 -0.8217 C.ar 1 UNL111111111 0.1159 14 CL 1.1260 -2.7875 -1.6794 Cl 1 UNL111111111 -0.0187 15 C 0.0315 1.0484 0.3145 C.ar 1 UNL111111111 -0.2603 16 C 1.1704 0.3610 0.7228 C.ar 1 UNL111111111 0.1111 17 CL 2.1490 1.1869 1.8423 Cl 1 UNL111111111 -0.0080 18 C 1.5221 -0.8889 0.2122 C.ar 1 UNL111111111 -0.4501 19 S 2.9263 -1.8001 0.8205 S.O2 1 UNL111111111 2.3360 20 O 3.2231 -1.3796 2.1662 O.2 1 UNL111111111 -0.8876 21 O 2.7802 -3.2073 0.5494 O.2 1 UNL111111111 -0.8532 22 N 4.1734 -1.2158 -0.2566 N.pl3 1 UNL111111111 -0.7648 23 C 4.2991 0.1823 -0.3047 C.ar 1 UNL111111111 -0.0886 24 C 3.7434 1.0057 -1.3093 C.ar 1 UNL111111111 0.0765 25 C 2.9705 0.6397 -2.5061 C.3 1 UNL111111111 -0.4391 26 N 4.0595 2.3010 -0.9559 N.ar 1 UNL111111111 -0.1082 27 C 3.7004 3.5310 -1.6364 C.3 1 UNL111111111 -0.2291 28 N 4.7910 2.3584 0.1896 N.ar 1 UNL111111111 -0.2923 29 C 4.9527 1.0780 0.6123 C.ar 1 UNL111111111 0.0973 30 C 5.6661 0.7384 1.8543 C.3 1 UNL111111111 -0.4345 31 H -7.2383 1.6566 -0.9403 H 1 UNL111111111 0.1141 32 H -6.5037 2.6171 0.3778 H 1 UNL111111111 0.1419 33 H -7.5010 1.1706 2.1167 H 1 UNL111111111 0.1583 34 H -8.7930 1.7356 1.0193 H 1 UNL111111111 0.1363 35 H -8.6340 -0.2203 -1.2735 H 1 UNL111111111 0.1161 36 H -9.4109 -1.5693 -0.3978 H 1 UNL111111111 0.1468 37 H -10.0445 0.0782 -0.2176 H 1 UNL111111111 0.1465 38 H -6.6527 -1.1432 1.8929 H 1 UNL111111111 0.1592 39 H -7.3633 -2.2152 0.6528 H 1 UNL111111111 0.1375 40 H -5.0936 -1.3277 -0.0310 H 1 UNL111111111 0.1449 41 H -6.3615 -0.8254 -1.1854 H 1 UNL111111111 0.1142 42 H -4.7257 0.9176 -1.8015 H 1 UNL111111111 0.1135 43 H -4.5158 2.2999 -0.6936 H 1 UNL111111111 0.1376 44 H -3.0782 0.8639 0.8279 H 1 UNL111111111 0.1660 45 H -3.2187 -0.4875 -0.2931 H 1 UNL111111111 0.1471 46 H -2.2515 1.0337 -2.1614 H 1 UNL111111111 0.1544 47 H -1.9810 2.2782 -0.9418 H 1 UNL111111111 0.1566 48 H -1.0412 -1.1419 -2.0514 H 1 UNL111111111 0.1775 49 H -0.2264 2.0109 0.7580 H 1 UNL111111111 0.1814 50 H 5.0658 -1.7081 -0.2401 H 1 UNL111111111 0.3116 51 H 1.8972 0.8574 -2.3878 H 1 UNL111111111 0.1606 52 H 3.3195 1.1579 -3.4106 H 1 UNL111111111 0.1565 53 H 3.0601 -0.4463 -2.7066 H 1 UNL111111111 0.1924 54 H 2.6013 3.6454 -1.6724 H 1 UNL111111111 0.1529 55 H 4.1202 4.4072 -1.0985 H 1 UNL111111111 0.1842 56 H 4.0995 3.5362 -2.6676 H 1 UNL111111111 0.1545 57 H 6.5554 0.1223 1.6600 H 1 UNL111111111 0.1578 58 H 5.9973 1.6347 2.4016 H 1 UNL111111111 0.1664 59 H 5.0086 0.1650 2.5423 H 1 UNL111111111 0.2038 @BOND 1 1 2 1 2 1 7 1 3 1 31 1 4 1 32 1 5 2 3 1 6 2 33 1 7 2 34 1 8 3 4 1 9 3 5 1 10 4 35 1 11 4 36 1 12 4 37 1 13 5 6 1 14 5 38 1 15 5 39 1 16 6 7 1 17 6 40 1 18 6 41 1 19 7 8 1 20 8 9 1 21 8 42 1 22 8 43 1 23 9 10 1 24 9 44 1 25 9 45 1 26 10 11 1 27 10 46 1 28 10 47 1 29 11 12 ar 30 11 15 ar 31 12 13 ar 32 12 48 1 33 13 14 1 34 13 18 ar 35 15 16 ar 36 15 49 1 37 16 17 1 38 16 18 ar 39 18 19 1 40 19 20 2 41 19 21 2 42 19 22 1 43 22 23 1 44 22 50 1 45 23 24 ar 46 23 29 ar 47 24 25 1 48 24 26 ar 49 25 51 1 50 25 52 1 51 25 53 1 52 26 27 1 53 26 28 ar 54 27 54 1 55 27 55 1 56 27 56 1 57 28 29 ar 58 29 30 1 59 30 57 1 60 30 58 1 61 30 59 1