@MOLECULE methyl 2,3,5-trichlorophenyl sulfone 18 18 0 0 0 SMALL GASTEIGER @ATOM 1 CL -1.1247 2.1718 -0.0199 Cl 1 UNL1111111111 -0.0111 2 CL 1.9071 2.7375 0.0125 Cl 1 UNL1111111111 -0.0188 3 CL 2.9041 -2.4777 0.0193 Cl 1 UNL1111111111 -0.0409 4 S -2.2367 -0.8891 -0.0871 S.O2 1 UNL1111111111 2.2477 5 O -2.8068 -0.2524 -1.2465 O.2 1 UNL1111111111 -0.8708 6 O -2.2622 -2.3275 0.0629 O.2 1 UNL1111111111 -0.9066 7 C -0.4965 -0.4431 -0.0221 C.ar 1 UNL1111111111 -0.3773 8 C -0.0338 0.8673 -0.0163 C.ar 1 UNL1111111111 0.0170 9 C 0.4242 -1.4893 -0.0108 C.ar 1 UNL1111111111 -0.0889 10 C -2.9397 -0.1661 1.3746 C.3 1 UNL1111111111 -0.7550 11 C 1.3323 1.1383 0.0005 C.ar 1 UNL1111111111 -0.0297 12 C 1.7846 -1.1949 0.0060 C.ar 1 UNL1111111111 -0.0072 13 C 2.2668 0.1084 0.0105 C.ar 1 UNL1111111111 -0.1432 14 H 0.0872 -2.5408 -0.0172 H 1 UNL1111111111 0.2139 15 H -3.5288 0.7336 1.1418 H 1 UNL1111111111 0.1989 16 H -3.6279 -0.8690 1.8686 H 1 UNL1111111111 0.1967 17 H -2.1975 0.1178 2.1284 H 1 UNL1111111111 0.1828 18 H 3.3405 0.3185 0.0191 H 1 UNL1111111111 0.1924 @BOND 1 1 8 1 2 2 11 1 3 3 12 1 4 4 5 2 5 4 6 2 6 4 7 1 7 4 10 1 8 7 8 ar 9 7 9 ar 10 8 11 ar 11 9 12 ar 12 9 14 1 13 10 15 1 14 10 16 1 15 10 17 1 16 11 13 ar 17 12 13 ar 18 13 18 1