@MOLECULE 3-chloro-8-quinolinecarboxylic acid 20 21 0 0 0 SMALL GASTEIGER @ATOM 1 CL -3.9682 -0.5020 -0.0053 Cl 1 UNL1111111111 -0.0380 2 O 2.9491 -1.4641 -1.1582 O.3 1 UNL1111111111 -0.5346 3 O 3.1671 -1.5499 1.0641 O.2 1 UNL1111111111 -0.4738 4 N -0.1131 -1.2180 0.0466 N.ar 1 UNL1111111111 -0.3447 5 C -0.3823 1.2137 -0.0020 C.ar 1 UNL1111111111 -0.0790 6 C 0.4282 0.0487 0.0277 C.ar 1 UNL1111111111 0.1684 7 C 1.8454 0.1942 0.0414 C.ar 1 UNL1111111111 -0.1096 8 C 0.2350 2.4910 -0.0201 C.ar 1 UNL1111111111 -0.1095 9 C -1.7953 1.0458 -0.0131 C.ar 1 UNL1111111111 -0.1096 10 C 2.4180 1.4409 0.0212 C.ar 1 UNL1111111111 -0.0785 11 C 1.6026 2.5996 -0.0086 C.ar 1 UNL1111111111 -0.1542 12 C -2.2937 -0.2259 0.0062 C.ar 1 UNL1111111111 -0.0864 13 C -1.4228 -1.3563 0.0370 C.ar 1 UNL1111111111 0.0688 14 C 2.6939 -1.0174 0.0974 C.2 1 UNL1111111111 0.6570 15 H -0.3970 3.3796 -0.0435 H 1 UNL1111111111 0.1619 16 H -2.4400 1.9262 -0.0361 H 1 UNL1111111111 0.1793 17 H 3.5042 1.5586 0.0283 H 1 UNL1111111111 0.1696 18 H 2.0840 3.5779 -0.0229 H 1 UNL1111111111 0.1647 19 H -1.8192 -2.3830 0.0543 H 1 UNL1111111111 0.1966 20 H 3.4631 -2.3109 -1.1739 H 1 UNL1111111111 0.3518 @BOND 1 1 12 1 2 2 14 1 3 2 20 1 4 3 14 2 5 4 6 ar 6 4 13 ar 7 5 6 ar 8 5 8 ar 9 5 9 ar 10 6 7 ar 11 7 10 ar 12 7 14 1 13 8 11 ar 14 8 15 1 15 9 12 ar 16 9 16 1 17 10 11 ar 18 10 17 1 19 11 18 1 20 12 13 ar 21 13 19 1