@MOLECULE 1-hydroxyindole-2-carboxylic acid 20 21 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.7714 -2.0410 -0.2682 O.3 1 UNL1111111111 -0.2754 2 O 3.1850 1.4210 -0.0765 O.3 1 UNL1111111111 -0.5184 3 O 3.2011 -0.8122 0.0612 O.2 1 UNL1111111111 -0.5352 4 N 0.3519 -0.8399 0.2781 N.ar 1 UNL1111111111 -0.1048 5 C -0.9974 -0.5043 0.0667 C.ar 1 UNL1111111111 0.1292 6 C -1.0711 0.9249 0.0014 C.ar 1 UNL1111111111 -0.1068 7 C 1.1226 0.3380 0.0430 C.ar 1 UNL1111111111 -0.1070 8 C 0.2789 1.4278 -0.0073 C.ar 1 UNL1111111111 -0.0895 9 C -2.1419 -1.3071 0.0535 C.ar 1 UNL1111111111 -0.1809 10 C -2.3241 1.5434 -0.0398 C.ar 1 UNL1111111111 -0.0934 11 C -3.3637 -0.6612 -0.0117 C.ar 1 UNL1111111111 -0.1039 12 C -3.4552 0.7463 -0.0513 C.ar 1 UNL1111111111 -0.1878 13 C 2.5696 0.2215 0.0174 C.2 1 UNL1111111111 0.6643 14 H 0.5599 2.4643 -0.0310 H 1 UNL1111111111 0.1807 15 H -2.0594 -2.3905 0.0899 H 1 UNL1111111111 0.1749 16 H -2.3965 2.6286 -0.0642 H 1 UNL1111111111 0.1568 17 H -4.2838 -1.2462 -0.0336 H 1 UNL1111111111 0.1537 18 H -4.4420 1.2046 -0.0926 H 1 UNL1111111111 0.1548 19 H 1.7459 -2.1218 0.0164 H 1 UNL1111111111 0.3288 20 H 4.1760 1.3434 -0.1069 H 1 UNL1111111111 0.3598 @BOND 1 1 4 1 2 1 19 1 3 2 13 1 4 2 20 1 5 3 13 2 6 4 5 ar 7 4 7 ar 8 5 6 ar 9 5 9 ar 10 6 8 ar 11 6 10 ar 12 7 8 ar 13 7 13 1 14 8 14 1 15 9 11 ar 16 9 15 1 17 10 12 ar 18 10 16 1 19 11 12 ar 20 11 17 1 21 12 18 1