@MOLECULE 2-amino-3,5-dimethylbenzoic acid 23 23 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.2924 2.6171 -0.0165 C.3 1 UNL1111111111 -0.4328 2 C -2.1915 -2.3751 0.0143 C.3 1 UNL1111111111 -0.4332 3 N 0.6806 -2.2203 -0.0089 N.pl3 1 UNL1111111111 -0.6054 4 O 2.5583 1.5438 0.0204 O.3 1 UNL1111111111 -0.5501 5 O 2.8846 -0.6472 -0.0141 O.2 1 UNL1111111111 -0.5808 6 C -2.1592 0.1137 0.0050 C.ar 1 UNL1111111111 -0.0734 7 C -0.1160 1.3889 0.0030 C.ar 1 UNL1111111111 -0.0312 8 C 2.0849 0.2676 0.0003 C.2 1 UNL1111111111 0.6867 9 C -1.4968 1.3568 0.0033 C.ar 1 UNL1111111111 -0.0870 10 C -1.4609 -1.0748 0.0030 C.ar 1 UNL1111111111 -0.1315 11 C -0.0309 -1.0511 -0.0048 C.ar 1 UNL1111111111 0.3150 12 C 0.6338 0.1997 -0.0010 C.ar 1 UNL1111111111 -0.3212 13 H -2.5488 2.9013 -1.0485 H 1 UNL1111111111 0.1550 14 H -3.2342 2.5220 0.5399 H 1 UNL1111111111 0.1490 15 H -1.7466 3.4623 0.4255 H 1 UNL1111111111 0.1541 16 H -1.9627 -2.9806 -0.8744 H 1 UNL1111111111 0.1529 17 H -1.9491 -2.9689 0.9084 H 1 UNL1111111111 0.1545 18 H -3.2825 -2.2385 0.0209 H 1 UNL1111111111 0.1555 19 H 0.2312 -3.1058 -0.0378 H 1 UNL1111111111 0.3053 20 H 1.6890 -2.1935 -0.0238 H 1 UNL1111111111 0.3416 21 H 3.5480 1.5799 0.0225 H 1 UNL1111111111 0.3549 22 H -3.2504 0.1026 0.0077 H 1 UNL1111111111 0.1504 23 H 0.4121 2.3471 0.0041 H 1 UNL1111111111 0.1719 @BOND 1 1 9 1 2 1 13 1 3 1 14 1 4 1 15 1 5 2 16 1 6 2 17 1 7 2 18 1 8 3 19 1 9 3 20 1 10 4 21 1 11 5 8 2 12 6 10 ar 13 6 22 1 14 7 9 ar 15 7 12 ar 16 7 23 1 17 8 4 1 18 8 12 1 19 9 6 ar 20 10 2 1 21 11 3 1 22 11 10 ar 23 12 11 ar