@MOLECULE 3-(dimethylamino)benzoic acid 23 23 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.5173 -0.1867 0.0366 O.3 1 UNL1111111111 -0.5536 2 O -2.5421 1.8068 -0.0939 O.2 1 UNL1111111111 -0.5058 3 N 2.4718 0.5163 0.2757 N.pl3 1 UNL1111111111 -0.3775 4 C 1.2563 -0.1646 0.0780 C.ar 1 UNL1111111111 0.2003 5 C 0.0317 0.5298 0.0523 C.ar 1 UNL1111111111 -0.2168 6 C 1.2278 -1.5753 0.0329 C.ar 1 UNL1111111111 -0.2289 7 C -1.1686 -0.1752 0.0003 C.ar 1 UNL1111111111 -0.0774 8 C 3.6846 -0.1551 -0.2250 C.3 1 UNL1111111111 -0.2588 9 C 2.4723 1.9615 -0.0116 C.3 1 UNL1111111111 -0.2592 10 C 0.0193 -2.2577 -0.0159 C.ar 1 UNL1111111111 -0.1108 11 C -1.1913 -1.5672 -0.0337 C.ar 1 UNL1111111111 -0.1524 12 C -2.4156 0.6100 -0.0259 C.2 1 UNL1111111111 0.6403 13 H -0.0008 1.6198 0.0755 H 1 UNL1111111111 0.1804 14 H 2.1534 -2.1445 0.0495 H 1 UNL1111111111 0.1577 15 H 3.8742 -1.0610 0.3790 H 1 UNL1111111111 0.1522 16 H 4.5640 0.4972 -0.0925 H 1 UNL1111111111 0.1499 17 H 3.6213 -0.4400 -1.2873 H 1 UNL1111111111 0.1337 18 H 3.4744 2.3823 0.1758 H 1 UNL1111111111 0.1485 19 H 1.7841 2.4723 0.6881 H 1 UNL1111111111 0.1597 20 H 2.1789 2.2060 -1.0451 H 1 UNL1111111111 0.1357 21 H 0.0179 -3.3476 -0.0419 H 1 UNL1111111111 0.1531 22 H -2.1374 -2.1068 -0.0736 H 1 UNL1111111111 0.1760 23 H -4.3644 0.3234 0.0215 H 1 UNL1111111111 0.3536 @BOND 1 1 12 1 2 1 23 1 3 2 12 2 4 3 4 1 5 3 8 1 6 3 9 1 7 4 5 ar 8 4 6 ar 9 5 7 ar 10 5 13 1 11 6 10 ar 12 6 14 1 13 7 11 ar 14 7 12 1 15 8 15 1 16 8 16 1 17 8 17 1 18 9 18 1 19 9 19 1 20 9 20 1 21 10 11 ar 22 10 21 1 23 11 22 1