@MOLECULE 4-(1,3-benzothiazol-2-yl)-2-methylaniline 29 31 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.0985 1.4095 0.4823 S.2 1 UNL1111111111 0.0779 2 N -1.1006 -1.0909 -0.3182 N.ar 1 UNL1111111111 -0.3855 3 N 5.3323 -0.6748 0.2140 N.pl3 1 UNL1111111111 -0.6263 4 C 1.1735 -0.2548 0.0281 C.ar 1 UNL1111111111 -0.1509 5 C -0.2681 -0.1401 0.0002 C.ar 1 UNL1111111111 0.1688 6 C 3.3820 0.6881 -0.3273 C.ar 1 UNL1111111111 -0.1182 7 C 2.0001 0.8079 -0.3596 C.ar 1 UNL1111111111 -0.0625 8 C -2.6506 0.6476 0.1925 C.ar 1 UNL1111111111 -0.1720 9 C -2.4450 -0.6909 -0.2247 C.ar 1 UNL1111111111 0.1156 10 C 3.9577 -0.5326 0.1065 C.ar 1 UNL1111111111 0.2699 11 C 1.7495 -1.4650 0.4381 C.ar 1 UNL1111111111 -0.0120 12 C 3.1267 -1.6072 0.4821 C.ar 1 UNL1111111111 -0.3126 13 C 4.2399 1.8330 -0.7474 C.3 1 UNL1111111111 -0.4341 14 C -3.9347 1.1605 0.3178 C.ar 1 UNL1111111111 -0.1234 15 C -3.5310 -1.5212 -0.5176 C.ar 1 UNL1111111111 -0.1366 16 C -5.0104 0.3275 0.0255 C.ar 1 UNL1111111111 -0.1539 17 C -4.8102 -0.9974 -0.3876 C.ar 1 UNL1111111111 -0.1414 18 H 1.5583 1.7435 -0.7083 H 1 UNL1111111111 0.1607 19 H 1.1011 -2.3007 0.7180 H 1 UNL1111111111 0.1702 20 H 3.5653 -2.5451 0.8083 H 1 UNL1111111111 0.1618 21 H 3.6482 2.7210 -1.0146 H 1 UNL1111111111 0.1597 22 H 4.9199 2.1465 0.0587 H 1 UNL1111111111 0.1537 23 H 4.8455 1.5850 -1.6305 H 1 UNL1111111111 0.1487 24 H -4.1049 2.1876 0.6369 H 1 UNL1111111111 0.1614 25 H -3.3584 -2.5477 -0.8376 H 1 UNL1111111111 0.1749 26 H -6.0266 0.7084 0.1180 H 1 UNL1111111111 0.1555 27 H -5.6747 -1.6227 -0.6094 H 1 UNL1111111111 0.1562 28 H 5.7221 -1.5793 0.3672 H 1 UNL1111111111 0.2973 29 H 5.9372 -0.0025 -0.2027 H 1 UNL1111111111 0.2969 @BOND 1 1 5 ar 2 1 8 ar 3 2 5 ar 4 2 9 ar 5 3 10 1 6 3 28 1 7 3 29 1 8 4 5 1 9 4 7 ar 10 4 11 ar 11 6 7 ar 12 6 10 ar 13 6 13 1 14 7 18 1 15 8 9 ar 16 8 14 ar 17 9 15 ar 18 10 12 ar 19 11 12 ar 20 11 19 1 21 12 20 1 22 13 21 1 23 13 22 1 24 13 23 1 25 14 16 ar 26 14 24 1 27 15 17 ar 28 15 25 1 29 16 17 ar 30 16 26 1 31 17 27 1