@MOLECULE 6-aminonicotinic acid 16 16 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.6048 -1.1686 0.0033 O.3 1 UNL1111111111 -0.5713 2 O 2.8158 1.0486 -0.0052 O.2 1 UNL1111111111 -0.5160 3 N -1.4302 -1.1801 -0.0014 N.ar 1 UNL1111111111 -0.5058 4 N -3.4763 -0.1013 -0.0025 N.pl3 1 UNL1111111111 -0.5884 5 C 0.6281 0.0681 0.0009 C.ar 1 UNL1111111111 -0.3545 6 C -0.0770 1.2817 0.0031 C.ar 1 UNL1111111111 0.0677 7 C -1.4588 1.2723 0.0031 C.ar 1 UNL1111111111 -0.3981 8 C -2.1139 0.0117 0.0001 C.ar 1 UNL1111111111 0.4492 9 C -0.0956 -1.1404 -0.0002 C.ar 1 UNL1111111111 0.2103 10 C 2.0811 0.0920 -0.0006 C.2 1 UNL1111111111 0.6729 11 H 0.4784 2.2270 0.0045 H 1 UNL1111111111 0.1750 12 H -2.0296 2.1917 0.0046 H 1 UNL1111111111 0.1760 13 H 0.4150 -2.1182 -0.0007 H 1 UNL1111111111 0.1926 14 H -3.9067 -1.0065 -0.0049 H 1 UNL1111111111 0.3222 15 H -4.0650 0.7005 0.0015 H 1 UNL1111111111 0.3100 16 H 3.5932 -1.1753 0.0024 H 1 UNL1111111111 0.3581 @BOND 1 1 10 1 2 1 16 1 3 2 10 2 4 3 8 ar 5 3 9 ar 6 4 8 1 7 4 14 1 8 4 15 1 9 5 6 ar 10 5 9 ar 11 5 10 1 12 6 7 ar 13 6 11 1 14 7 8 ar 15 7 12 1 16 9 13 1