@MOLECULE 4-dodecyl-n-(1,3,4-thiadiazol-2-yl)benzenesulfonamide 58 59 0 0 0 SMALL GASTEIGER @ATOM 1 S -5.9728 -0.5695 -0.2721 S.O2 1 UNL1111111111 2.3686 2 S -4.1378 3.5351 -0.6282 S.2 1 UNL1111111111 0.0769 3 O -6.5881 -0.9688 -1.5145 O.2 1 UNL1111111111 -0.8882 4 O -6.7051 -0.5786 0.9574 O.2 1 UNL1111111111 -0.8370 5 N -5.6123 1.1434 -0.6837 N.pl3 1 UNL1111111111 -0.7863 6 N -3.9752 1.5107 1.0180 N.ar 1 UNL1111111111 -0.3475 7 N -3.0526 2.3888 1.4213 N.ar 1 UNL1111111111 -0.0917 8 C 5.4239 -0.1223 0.0409 C.3 1 UNL1111111111 -0.2723 9 C 4.4116 -1.2369 0.3217 C.3 1 UNL1111111111 -0.2751 10 C 6.8548 -0.6670 0.1445 C.3 1 UNL1111111111 -0.2722 11 C 2.9749 -0.7757 0.0462 C.3 1 UNL1111111111 -0.2712 12 C 7.8794 0.4482 -0.0969 C.3 1 UNL1111111111 -0.2722 13 C 2.0101 -1.9408 0.2970 C.3 1 UNL1111111111 -0.2694 14 C 9.3090 -0.1010 -0.0100 C.3 1 UNL1111111111 -0.2746 15 C 0.5564 -1.5090 0.0864 C.3 1 UNL1111111111 -0.2602 16 C 10.3328 1.0137 -0.2576 C.3 1 UNL1111111111 -0.2720 17 C -0.3871 -2.7067 0.2913 C.3 1 UNL1111111111 -0.3151 18 C 11.7641 0.4674 -0.1708 C.3 1 UNL1111111111 -0.2510 19 C -1.8043 -2.2498 0.1550 C.ar 1 UNL1111111111 0.1008 20 C 12.7862 1.5784 -0.4110 C.3 1 UNL1111111111 -0.4397 21 C -2.5027 -1.8211 1.2842 C.ar 1 UNL1111111111 -0.2219 22 C -2.4230 -2.2229 -1.1001 C.ar 1 UNL1111111111 -0.2324 23 C -4.4036 -1.2755 -0.0985 C.ar 1 UNL1111111111 -0.4483 24 C -3.7991 -1.3287 1.1591 C.ar 1 UNL1111111111 0.0180 25 C -3.7208 -1.7420 -1.2254 C.ar 1 UNL1111111111 -0.0382 26 C -4.6789 1.8988 -0.0643 C.ar 1 UNL1111111111 0.2660 27 C -2.9741 3.4935 0.7150 C.ar 1 UNL1111111111 -0.1910 28 H 5.2553 0.3054 -0.9642 H 1 UNL1111111111 0.1370 29 H 5.2793 0.7111 0.7529 H 1 UNL1111111111 0.1374 30 H 4.6428 -2.1221 -0.3005 H 1 UNL1111111111 0.1361 31 H 4.5038 -1.5729 1.3715 H 1 UNL1111111111 0.1363 32 H 7.0166 -1.1221 1.1400 H 1 UNL1111111111 0.1365 33 H 7.0029 -1.4810 -0.5884 H 1 UNL1111111111 0.1360 34 H 2.8815 -0.4149 -0.9943 H 1 UNL1111111111 0.1376 35 H 2.7180 0.0862 0.6928 H 1 UNL1111111111 0.1406 36 H 7.7105 0.9099 -1.0876 H 1 UNL1111111111 0.1366 37 H 7.7391 1.2576 0.6435 H 1 UNL1111111111 0.1369 38 H 2.1444 -2.3232 1.3265 H 1 UNL1111111111 0.1379 39 H 2.2598 -2.7830 -0.3760 H 1 UNL1111111111 0.1364 40 H 9.4791 -0.5586 0.9820 H 1 UNL1111111111 0.1364 41 H 9.4479 -0.9133 -0.7468 H 1 UNL1111111111 0.1362 42 H 0.4208 -1.0888 -0.9277 H 1 UNL1111111111 0.1415 43 H 0.2916 -0.6928 0.7873 H 1 UNL1111111111 0.1505 44 H 10.1940 1.8272 0.4783 H 1 UNL1111111111 0.1367 45 H 10.1631 1.4711 -1.2500 H 1 UNL1111111111 0.1365 46 H -0.2091 -3.1603 1.2879 H 1 UNL1111111111 0.1544 47 H -0.1510 -3.5061 -0.4380 H 1 UNL1111111111 0.1519 48 H 11.9334 0.0053 0.8200 H 1 UNL1111111111 0.1336 49 H 11.9055 -0.3427 -0.9106 H 1 UNL1111111111 0.1334 50 H 12.6593 2.0323 -1.3999 H 1 UNL1111111111 0.1423 51 H 12.6912 2.3773 0.3328 H 1 UNL1111111111 0.1424 52 H 13.8109 1.1951 -0.3531 H 1 UNL1111111111 0.1402 53 H -2.0254 -1.8414 2.2624 H 1 UNL1111111111 0.1641 54 H -1.8837 -2.5692 -1.9765 H 1 UNL1111111111 0.1571 55 H -4.3191 -0.9627 2.0561 H 1 UNL1111111111 0.1850 56 H -4.1931 -1.7303 -2.2143 H 1 UNL1111111111 0.1680 57 H -6.1643 1.5569 -1.4377 H 1 UNL1111111111 0.3403 58 H -2.2829 4.2945 0.9250 H 1 UNL1111111111 0.2013 @BOND 1 1 3 2 2 1 4 2 3 1 5 1 4 1 23 1 5 2 26 ar 6 2 27 ar 7 5 26 1 8 5 57 1 9 6 7 ar 10 6 26 ar 11 7 27 ar 12 8 9 1 13 8 10 1 14 8 28 1 15 8 29 1 16 9 11 1 17 9 30 1 18 9 31 1 19 10 12 1 20 10 32 1 21 10 33 1 22 11 13 1 23 11 34 1 24 11 35 1 25 12 14 1 26 12 36 1 27 12 37 1 28 13 15 1 29 13 38 1 30 13 39 1 31 14 16 1 32 14 40 1 33 14 41 1 34 15 17 1 35 15 42 1 36 15 43 1 37 16 18 1 38 16 44 1 39 16 45 1 40 17 19 1 41 17 46 1 42 17 47 1 43 18 20 1 44 18 48 1 45 18 49 1 46 19 21 ar 47 19 22 ar 48 20 50 1 49 20 51 1 50 20 52 1 51 21 24 ar 52 21 53 1 53 22 25 ar 54 22 54 1 55 23 24 ar 56 23 25 ar 57 24 55 1 58 25 56 1 59 27 58 1