@MOLECULE 4-{[4-amino-5-(3-aminobenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide 41 43 0 0 0 SMALL GASTEIGER @ATOM 1 N 0.2153 1.2780 0.0418 N.ar 1 UNL111111111 -0.5746 2 N -0.7043 -0.9011 0.4858 N.pl3 1 UNL111111111 -0.4670 3 N 1.5565 3.1910 -0.3526 N.pl3 1 UNL111111111 -0.5347 4 N 6.4924 -2.3616 -1.8816 N.pl3 1 UNL111111111 -0.6313 5 N -6.9010 -0.6296 -1.7090 N.3 1 UNL111111111 -0.9451 6 C 2.5847 1.0073 0.0653 C.ar 1 UNL111111111 -0.5937 7 C 1.4866 1.8704 -0.0888 C.ar 1 UNL111111111 0.4997 8 C 0.3238 -0.0200 0.3055 C.ar 1 UNL111111111 0.3299 9 C -2.0854 -0.6297 0.3567 C.ar 1 UNL111111111 0.2559 10 C 3.9503 1.4197 -0.0568 C.2 1 UNL111111111 0.5354 11 C 5.0023 0.3725 0.0856 C.ar 1 UNL111111111 -0.0342 12 C 5.6969 0.2633 1.2880 C.ar 1 UNL111111111 -0.2107 13 C 6.6746 -0.7226 1.4205 C.ar 1 UNL111111111 -0.0655 14 C 6.9625 -1.5830 0.3687 C.ar 1 UNL111111111 -0.2868 15 C 6.2581 -1.4587 -0.8443 C.ar 1 UNL111111111 0.2595 16 C 5.2684 -0.4684 -0.9871 C.ar 1 UNL111111111 -0.2713 17 C -2.6060 0.5971 -0.0702 C.ar 1 UNL111111111 -0.2472 18 C -3.9831 0.7513 -0.1966 C.ar 1 UNL111111111 -0.0096 19 C -4.8445 -0.3052 0.0948 C.ar 1 UNL111111111 -0.4252 20 C -4.3269 -1.5226 0.5397 C.ar 1 UNL111111111 -0.0100 21 C -2.9559 -1.6943 0.6714 C.ar 1 UNL111111111 -0.2876 22 O 4.2521 2.5809 -0.2737 O.2 1 UNL111111111 -0.5216 23 O -6.8795 1.3104 -0.0681 O.2 1 UNL111111111 -0.9161 24 O -7.2467 -1.0506 0.7696 O.2 1 UNL111111111 -0.9188 25 S 2.0393 -0.6058 0.4128 S.2 1 UNL111111111 0.1947 26 S -6.5723 -0.1008 -0.0847 S.O2 1 UNL111111111 2.3594 27 H -0.4625 -1.8593 0.7501 H 1 UNL111111111 0.3296 28 H 0.7346 3.7516 -0.4457 H 1 UNL111111111 0.3197 29 H 2.4743 3.6175 -0.4420 H 1 UNL111111111 0.3520 30 H 7.3295 -2.9049 -1.8594 H 1 UNL111111111 0.2892 31 H 6.1660 -2.1309 -2.7969 H 1 UNL111111111 0.2914 32 H -7.4656 -1.4570 -1.8061 H 1 UNL111111111 0.2929 33 H -7.1976 0.0764 -2.3619 H 1 UNL111111111 0.2934 34 H 5.4837 0.9423 2.1095 H 1 UNL111111111 0.1636 35 H 7.2214 -0.8161 2.3587 H 1 UNL111111111 0.1476 36 H 7.7219 -2.3494 0.4817 H 1 UNL111111111 0.1563 37 H 4.7227 -0.3648 -1.9204 H 1 UNL111111111 0.1665 38 H -1.9506 1.4403 -0.3056 H 1 UNL111111111 0.2063 39 H -4.3753 1.7242 -0.5230 H 1 UNL111111111 0.1764 40 H -4.9943 -2.3547 0.7990 H 1 UNL111111111 0.1728 41 H -2.5638 -2.6464 1.0185 H 1 UNL111111111 0.1587 @BOND 1 1 8 ar 2 2 9 1 3 2 27 1 4 3 7 1 5 3 28 1 6 3 29 1 7 4 30 1 8 4 31 1 9 5 32 1 10 5 33 1 11 6 25 ar 12 7 1 ar 13 7 6 ar 14 8 2 1 15 8 25 ar 16 9 21 ar 17 9 17 ar 18 10 6 1 19 10 11 1 20 11 12 ar 21 11 16 ar 22 12 13 ar 23 12 34 1 24 13 14 ar 25 13 35 1 26 14 36 1 27 15 4 1 28 15 14 ar 29 16 15 ar 30 16 37 1 31 17 18 ar 32 17 38 1 33 18 19 ar 34 18 39 1 35 19 26 1 36 20 19 ar 37 20 40 1 38 21 20 ar 39 21 41 1 40 22 10 2 41 23 26 2 42 26 5 1 43 26 24 2