@MOLECULE (r)-n-(4-(4-(dibutylamino)-1-hydroxybutyl)phenyl)methanesulfonamide 59 59 0 0 0 SMALL GASTEIGER @ATOM 1 S -4.5818 -0.6400 0.0643 S.O2 1 UNL1111111111 2.3834 2 O 1.5863 3.8802 -1.0974 O.3 1 UNL1111111111 -0.5543 3 O -5.0606 -1.8785 -0.4996 O.2 1 UNL1111111111 -0.9062 4 O -4.0977 -0.5607 1.4165 O.2 1 UNL1111111111 -0.8971 5 N 2.7827 -0.6767 0.9998 N.3 1 UNL1111111111 -0.4457 6 N -3.3020 -0.1810 -1.0371 N.pl3 1 UNL1111111111 -0.8528 7 C 3.1461 0.3609 1.9955 C.3 1 UNL1111111111 -0.1089 8 C 2.2373 1.5945 1.8102 C.3 1 UNL1111111111 -0.2666 9 C 3.9214 -1.5829 0.7181 C.3 1 UNL1111111111 -0.1128 10 C 1.5668 -1.4253 1.3989 C.3 1 UNL1111111111 -0.1121 11 C 2.4550 2.2328 0.4353 C.3 1 UNL1111111111 -0.3230 12 C 4.7920 -0.9319 -0.3755 C.3 1 UNL1111111111 -0.2770 13 C 0.8656 -1.9293 0.1229 C.3 1 UNL1111111111 -0.2858 14 C 1.2508 3.0993 0.0314 C.3 1 UNL1111111111 0.1565 15 C 5.9503 -1.8573 -0.7601 C.3 1 UNL1111111111 -0.2548 16 C -0.4749 -2.5825 0.4707 C.3 1 UNL1111111111 -0.2577 17 C 0.0410 2.2467 -0.2469 C.ar 1 UNL1111111111 -0.1193 18 C 6.8174 -1.2143 -1.8428 C.3 1 UNL1111111111 -0.4362 19 C -1.1215 -3.1823 -0.7784 C.3 1 UNL1111111111 -0.4347 20 C -1.0302 2.2399 0.6445 C.ar 1 UNL1111111111 -0.0970 21 C -0.0019 1.4268 -1.3757 C.ar 1 UNL1111111111 -0.0838 22 C -2.1361 1.4238 0.4285 C.ar 1 UNL1111111111 -0.2580 23 C -1.1007 0.6131 -1.6147 C.ar 1 UNL1111111111 -0.2668 24 C -2.1820 0.6070 -0.7107 C.ar 1 UNL1111111111 0.2562 25 C -5.7924 0.6278 -0.1781 C.3 1 UNL1111111111 -0.7510 26 H 4.2040 0.6632 1.8364 H 1 UNL1111111111 0.1360 27 H 3.0752 -0.0067 3.0406 H 1 UNL1111111111 0.1107 28 H 2.4387 2.3251 2.6134 H 1 UNL1111111111 0.1305 29 H 1.1769 1.2913 1.9229 H 1 UNL1111111111 0.1487 30 H 4.5290 -1.8069 1.6185 H 1 UNL1111111111 0.1117 31 H 3.5392 -2.5585 0.3465 H 1 UNL1111111111 0.1370 32 H 1.7854 -2.2699 2.0839 H 1 UNL1111111111 0.1133 33 H 0.8753 -0.7457 1.9441 H 1 UNL1111111111 0.1390 34 H 3.3724 2.8484 0.4290 H 1 UNL1111111111 0.1477 35 H 2.6188 1.4338 -0.3194 H 1 UNL1111111111 0.1717 36 H 4.1619 -0.7069 -1.2575 H 1 UNL1111111111 0.1512 37 H 5.1746 0.0454 -0.0310 H 1 UNL1111111111 0.1392 38 H 0.7108 -1.0750 -0.5669 H 1 UNL1111111111 0.1545 39 H 1.5147 -2.6362 -0.4223 H 1 UNL1111111111 0.1392 40 H 1.0438 3.8911 0.7895 H 1 UNL1111111111 0.1437 41 H 6.5665 -2.0874 0.1295 H 1 UNL1111111111 0.1317 42 H 5.5590 -2.8284 -1.1183 H 1 UNL1111111111 0.1341 43 H -0.3350 -3.3674 1.2369 H 1 UNL1111111111 0.1334 44 H -1.1536 -1.8348 0.9278 H 1 UNL1111111111 0.1455 45 H 6.2365 -1.0062 -2.7484 H 1 UNL1111111111 0.1428 46 H 7.6486 -1.8681 -2.1273 H 1 UNL1111111111 0.1378 47 H 7.2461 -0.2654 -1.5013 H 1 UNL1111111111 0.1421 48 H -1.2488 -2.4295 -1.5625 H 1 UNL1111111111 0.1314 49 H -2.1109 -3.5980 -0.5503 H 1 UNL1111111111 0.1487 50 H -0.5123 -3.9921 -1.1940 H 1 UNL1111111111 0.1397 51 H -1.0046 2.8746 1.5304 H 1 UNL1111111111 0.1481 52 H 0.8380 1.4083 -2.0700 H 1 UNL1111111111 0.1457 53 H 1.7908 3.3214 -1.8717 H 1 UNL1111111111 0.3112 54 H -2.9316 1.4176 1.1717 H 1 UNL1111111111 0.1791 55 H -1.1208 -0.0206 -2.4966 H 1 UNL1111111111 0.1559 56 H -3.1500 -0.8371 -1.8077 H 1 UNL1111111111 0.3198 57 H -5.3727 1.5361 -0.6345 H 1 UNL1111111111 0.1959 58 H -6.2512 0.9377 0.7719 H 1 UNL1111111111 0.1937 59 H -6.6087 0.2933 -0.8346 H 1 UNL1111111111 0.1950 @BOND 1 1 3 2 2 1 4 2 3 1 6 1 4 1 25 1 5 2 14 1 6 2 53 1 7 5 7 1 8 5 9 1 9 5 10 1 10 6 24 1 11 6 56 1 12 7 8 1 13 7 26 1 14 7 27 1 15 8 11 1 16 8 28 1 17 8 29 1 18 9 12 1 19 9 30 1 20 9 31 1 21 10 13 1 22 10 32 1 23 10 33 1 24 11 14 1 25 11 34 1 26 11 35 1 27 12 15 1 28 12 36 1 29 12 37 1 30 13 16 1 31 13 38 1 32 13 39 1 33 14 17 1 34 14 40 1 35 15 18 1 36 15 41 1 37 15 42 1 38 16 19 1 39 16 43 1 40 16 44 1 41 17 20 ar 42 17 21 ar 43 18 45 1 44 18 46 1 45 18 47 1 46 19 48 1 47 19 49 1 48 19 50 1 49 20 22 ar 50 20 51 1 51 21 23 ar 52 21 52 1 53 22 24 ar 54 22 54 1 55 23 24 ar 56 23 55 1 57 25 57 1 58 25 58 1 59 25 59 1