@MOLECULE 6-hydroxy-1,3-benzothiazole-2-sulfonamide 20 21 0 0 0 SMALL GASTEIGER @ATOM 1 O 5.0036 -0.2945 -0.0296 O.3 1 UNL1111111111 -0.4479 2 C 3.6775 -0.0267 -0.0110 C.ar 1 UNL1111111111 0.3115 3 C 2.7122 -1.0304 -0.0167 C.ar 1 UNL1111111111 -0.3181 4 C 1.3849 -0.6184 -0.0017 C.ar 1 UNL1111111111 -0.1052 5 S -0.0845 -1.5667 -0.0101 S.2 1 UNL1111111111 0.2737 6 C -1.0388 -0.0683 0.0135 C.ar 1 UNL1111111111 -0.2951 7 S -2.8296 0.0388 0.0225 S.O2 1 UNL1111111111 2.3778 8 N -3.1567 1.7122 -0.1948 N.3 1 UNL1111111111 -0.9316 9 O -3.2967 -0.6255 -1.1657 O.2 1 UNL1111111111 -0.8880 10 O -3.2375 -0.3753 1.3333 O.2 1 UNL1111111111 -0.8485 11 N -0.3269 1.0231 0.0293 N.ar 1 UNL1111111111 -0.3287 12 C 1.0479 0.7588 0.0206 C.ar 1 UNL1111111111 0.0101 13 C 2.0470 1.7488 0.0312 C.ar 1 UNL1111111111 -0.0533 14 C 3.3677 1.3530 0.0143 C.ar 1 UNL1111111111 -0.2444 15 H 5.1946 -1.2665 -0.0490 H 1 UNL1111111111 0.3321 16 H 2.9879 -2.0797 -0.0319 H 1 UNL1111111111 0.1763 17 H -2.5335 2.3816 0.2245 H 1 UNL1111111111 0.3086 18 H -3.4768 2.0106 -1.0990 H 1 UNL1111111111 0.3038 19 H 1.7630 2.8022 0.0527 H 1 UNL1111111111 0.1758 20 H 4.1848 2.0750 0.0200 H 1 UNL1111111111 0.1911 @BOND 1 1 2 1 2 1 15 1 3 2 3 ar 4 2 14 ar 5 3 4 ar 6 3 16 1 7 4 5 ar 8 4 12 ar 9 5 6 ar 10 6 7 1 11 6 11 ar 12 7 8 1 13 7 9 2 14 7 10 2 15 8 17 1 16 8 18 1 17 11 12 ar 18 12 13 ar 19 13 14 ar 20 13 19 1 21 14 20 1