@MOLECULE 5-{[2-(dimethylamino)ethyl]amino}-2-methyl-1,3-benzothiazole-4,7-dione 33 34 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.8812 -1.0096 -0.0002 S.2 1 UNL1111111111 0.2882 2 O -0.3091 2.3703 0.0323 O.2 1 UNL1111111111 -0.3612 3 O -1.3664 -2.9018 -0.1624 O.2 1 UNL1111111111 -0.4486 4 N 1.7639 0.6902 -0.1035 N.pl3 1 UNL1111111111 -0.4712 5 N 5.3804 -0.1990 -0.0997 N.3 1 UNL1111111111 -0.3856 6 N -3.0671 1.4575 0.0913 N.ar 1 UNL1111111111 -0.3304 7 C 2.9616 -0.1490 -0.1941 C.3 1 UNL1111111111 -0.0741 8 C 4.2256 0.7229 0.0064 C.3 1 UNL1111111111 -0.1516 9 C 0.5181 0.1518 -0.0993 C.2 1 UNL1111111111 0.2040 10 C -1.9476 0.6449 0.0144 C.ar 1 UNL1111111111 -0.0091 11 C -0.5890 1.2008 -0.0093 C.2 1 UNL1111111111 0.4290 12 C -2.1922 -0.7126 -0.0422 C.ar 1 UNL1111111111 -0.2962 13 C 0.2345 -1.1803 -0.1589 C.2 1 UNL1111111111 -0.5025 14 C -1.1100 -1.7186 -0.1263 C.2 1 UNL1111111111 0.5205 15 C 6.5445 0.4669 -0.7192 C.3 1 UNL1111111111 -0.2790 16 C 5.7422 -0.7571 1.2203 C.3 1 UNL1111111111 -0.2825 17 C -4.1794 0.7515 0.0952 C.ar 1 UNL1111111111 0.1004 18 C -5.5290 1.3322 0.1685 C.3 1 UNL1111111111 -0.4468 19 H 3.0049 -0.6583 -1.1871 H 1 UNL1111111111 0.1646 20 H 2.9207 -0.9559 0.5751 H 1 UNL1111111111 0.1580 21 H 4.2751 1.4974 -0.7888 H 1 UNL1111111111 0.1426 22 H 4.1800 1.2641 0.9742 H 1 UNL1111111111 0.1299 23 H 1.8772 1.6959 -0.0906 H 1 UNL1111111111 0.3281 24 H 1.0172 -1.9320 -0.2368 H 1 UNL1111111111 0.1971 25 H 7.3649 -0.2649 -0.8156 H 1 UNL1111111111 0.1499 26 H 6.2776 0.7831 -1.7418 H 1 UNL1111111111 0.1484 27 H 6.9226 1.3388 -0.1659 H 1 UNL1111111111 0.1210 28 H 4.8644 -1.2568 1.6622 H 1 UNL1111111111 0.1475 29 H 6.5153 -1.5315 1.0760 H 1 UNL1111111111 0.1508 30 H 6.1222 -0.0183 1.9412 H 1 UNL1111111111 0.1220 31 H -5.4845 2.4389 0.2174 H 1 UNL1111111111 0.1903 32 H -6.1450 1.0857 -0.7121 H 1 UNL1111111111 0.1735 33 H -6.0827 1.0050 1.0641 H 1 UNL1111111111 0.1735 @BOND 1 1 12 ar 2 1 17 ar 3 2 11 2 4 3 14 2 5 4 7 1 6 4 9 1 7 4 23 1 8 5 8 1 9 5 15 1 10 5 16 1 11 6 10 ar 12 6 17 ar 13 7 8 1 14 7 19 1 15 7 20 1 16 8 21 1 17 8 22 1 18 9 11 1 19 9 13 2 20 10 11 1 21 10 12 ar 22 12 14 1 23 13 14 1 24 13 24 1 25 15 25 1 26 15 26 1 27 15 27 1 28 16 28 1 29 16 29 1 30 16 30 1 31 17 18 1 32 18 31 1 33 18 32 1 34 18 33 1