@MOLECULE 4,4'-sulfonylbis(n-butylaniline) 53 54 0 0 0 SMALL GASTEIGER @ATOM 1 S 0.0003 2.7886 0.0037 S.O2 1 UNL1111111111 2.2584 2 O 0.2059 3.4984 1.2567 O.2 1 UNL1111111111 -0.9329 3 O -0.2094 3.5105 -1.2414 O.2 1 UNL1111111111 -0.9323 4 N 4.5190 -0.9648 -0.8139 N.pl3 1 UNL1111111111 -0.5528 5 N -4.5094 -0.9788 0.8077 N.pl3 1 UNL1111111111 -0.5531 6 C 1.3675 1.7137 -0.2295 C.ar 1 UNL1111111111 -0.4941 7 C -1.3647 1.7087 0.2292 C.ar 1 UNL1111111111 -0.4940 8 C 6.4520 -2.3890 -0.2836 C.3 1 UNL1111111111 -0.2932 9 C -6.4569 -2.3863 0.2807 C.3 1 UNL1111111111 -0.2933 10 C 5.4421 -1.3639 0.2577 C.3 1 UNL1111111111 -0.0744 11 C -5.4373 -1.3713 -0.2619 C.3 1 UNL1111111111 -0.0742 12 C 3.5184 -0.0412 -0.5921 C.ar 1 UNL1111111111 0.3089 13 C -3.5109 -0.0526 0.5882 C.ar 1 UNL1111111111 0.3091 14 C 7.4047 -2.8260 0.8359 C.3 1 UNL1111111111 -0.2448 15 C -7.4109 -2.8189 -0.8395 C.3 1 UNL1111111111 -0.2448 16 C 1.7267 1.3034 -1.5150 C.ar 1 UNL1111111111 0.0236 17 C -1.7185 1.2898 1.5136 C.ar 1 UNL1111111111 0.0236 18 C 2.1064 1.2730 0.8677 C.ar 1 UNL1111111111 0.0236 19 C -2.1066 1.2735 -0.8682 C.ar 1 UNL1111111111 0.0237 20 C 2.7871 0.4344 -1.7085 C.ar 1 UNL1111111111 -0.3449 21 C -2.7764 0.4171 1.7048 C.ar 1 UNL1111111111 -0.3453 22 C 3.1730 0.4008 0.7028 C.ar 1 UNL1111111111 -0.3427 23 C -3.1708 0.3981 -0.7054 C.ar 1 UNL1111111111 -0.3428 24 C 8.4143 -3.8486 0.3168 C.3 1 UNL1111111111 -0.4387 25 C -8.4413 -3.8177 -0.3147 C.3 1 UNL1111111111 -0.4387 26 H 5.9187 -3.2691 -0.6932 H 1 UNL1111111111 0.1519 27 H 7.0287 -1.9602 -1.1247 H 1 UNL1111111111 0.1440 28 H -5.9324 -3.2693 0.6948 H 1 UNL1111111111 0.1517 29 H -7.0320 -1.9487 1.1184 H 1 UNL1111111111 0.1442 30 H 4.8524 -1.8134 1.0916 H 1 UNL1111111111 0.1471 31 H 5.9726 -0.4750 0.6703 H 1 UNL1111111111 0.1366 32 H -5.9606 -0.4778 -0.6746 H 1 UNL1111111111 0.1368 33 H -4.8524 -1.8259 -1.0963 H 1 UNL1111111111 0.1469 34 H 6.8308 -3.2582 1.6783 H 1 UNL1111111111 0.1380 35 H 7.9372 -1.9475 1.2492 H 1 UNL1111111111 0.1380 36 H -6.8398 -3.2710 -1.6734 H 1 UNL1111111111 0.1380 37 H -7.9254 -1.9362 -1.2660 H 1 UNL1111111111 0.1380 38 H 4.8302 -1.1298 -1.7575 H 1 UNL1111111111 0.3061 39 H -4.8133 -1.1545 1.7519 H 1 UNL1111111111 0.3063 40 H 1.1784 1.6753 -2.3901 H 1 UNL1111111111 0.1649 41 H -1.1685 1.6575 2.3894 H 1 UNL1111111111 0.1651 42 H 1.8601 1.6197 1.8795 H 1 UNL1111111111 0.1634 43 H -1.8642 1.6272 -1.8783 H 1 UNL1111111111 0.1631 44 H 3.0573 0.1166 -2.7084 H 1 UNL1111111111 0.1539 45 H -3.0425 0.0925 2.7037 H 1 UNL1111111111 0.1539 46 H 3.7319 0.0664 1.5676 H 1 UNL1111111111 0.1558 47 H -3.7320 0.0679 -1.5703 H 1 UNL1111111111 0.1557 48 H 9.0255 -3.4367 -0.4943 H 1 UNL1111111111 0.1447 49 H 9.0986 -4.1691 1.1109 H 1 UNL1111111111 0.1440 50 H 7.9173 -4.7464 -0.0681 H 1 UNL1111111111 0.1449 51 H -9.0499 -3.3857 0.4879 H 1 UNL1111111111 0.1447 52 H -9.1266 -4.1352 -1.1092 H 1 UNL1111111111 0.1440 53 H -7.9624 -4.7196 0.0833 H 1 UNL1111111111 0.1448 @BOND 1 1 2 2 2 1 3 2 3 1 6 1 4 1 7 1 5 4 10 1 6 4 12 1 7 4 38 1 8 5 11 1 9 5 13 1 10 5 39 1 11 6 16 ar 12 6 18 ar 13 7 17 ar 14 7 19 ar 15 8 10 1 16 8 14 1 17 8 26 1 18 8 27 1 19 9 11 1 20 9 15 1 21 9 28 1 22 9 29 1 23 10 30 1 24 10 31 1 25 11 32 1 26 11 33 1 27 12 20 ar 28 12 22 ar 29 13 21 ar 30 13 23 ar 31 14 24 1 32 14 34 1 33 14 35 1 34 15 25 1 35 15 36 1 36 15 37 1 37 16 20 ar 38 16 40 1 39 17 21 ar 40 17 41 1 41 18 22 ar 42 18 42 1 43 19 23 ar 44 19 43 1 45 20 44 1 46 21 45 1 47 22 46 1 48 23 47 1 49 24 48 1 50 24 49 1 51 24 50 1 52 25 51 1 53 25 52 1 54 25 53 1