@MOLECULE 5-methoxy-2-methyl-3-indoleacetic acid 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.6533 1.1067 -0.0036 O.3 1 UNL1111111111 -0.3199 2 O 3.2675 2.5270 -0.1293 O.3 1 UNL1111111111 -0.5937 3 O 2.2913 1.3298 1.4690 O.2 1 UNL1111111111 -0.4839 4 N 0.4898 -2.4793 0.1123 N.ar 1 UNL1111111111 -0.3819 5 C 1.1128 -0.3774 -0.4977 C.ar 1 UNL1111111111 -0.1860 6 C -0.3029 -0.3662 -0.2611 C.ar 1 UNL1111111111 0.0274 7 C -0.6708 -1.6941 0.1215 C.ar 1 UNL1111111111 0.0238 8 C 1.5662 -1.6717 -0.2510 C.ar 1 UNL1111111111 0.1763 9 C 1.9188 0.7860 -0.9027 C.3 1 UNL1111111111 -0.2978 10 C -1.2812 0.6326 -0.3248 C.ar 1 UNL1111111111 -0.2878 11 C -1.9913 -2.0425 0.4339 C.ar 1 UNL1111111111 -0.1340 12 C 2.9365 -2.2162 -0.3135 C.3 1 UNL1111111111 -0.4552 13 C -2.5769 0.2698 -0.0032 C.ar 1 UNL1111111111 0.2316 14 C -2.9461 -1.0506 0.3691 C.ar 1 UNL1111111111 -0.2196 15 C 2.4574 1.5095 0.2957 C.2 1 UNL1111111111 0.6484 16 C -3.4026 2.4750 -0.2892 C.3 1 UNL1111111111 -0.2010 17 H 0.5375 -3.4349 0.3723 H 1 UNL1111111111 0.3119 18 H 1.3127 1.4966 -1.5170 H 1 UNL1111111111 0.1885 19 H 2.7613 0.4921 -1.5723 H 1 UNL1111111111 0.1812 20 H -1.0064 1.6412 -0.6044 H 1 UNL1111111111 0.1661 21 H -2.2486 -3.0576 0.7210 H 1 UNL1111111111 0.1570 22 H 3.5277 -1.7326 -1.1080 H 1 UNL1111111111 0.1702 23 H 3.4744 -2.0391 0.6356 H 1 UNL1111111111 0.1781 24 H 2.9647 -3.2973 -0.5087 H 1 UNL1111111111 0.1591 25 H -3.9894 -1.2520 0.6035 H 1 UNL1111111111 0.1721 26 H -4.3999 2.9215 -0.1818 H 1 UNL1111111111 0.1478 27 H -3.0362 2.5974 -1.3128 H 1 UNL1111111111 0.1314 28 H -2.7095 2.9079 0.4398 H 1 UNL1111111111 0.1372 29 H 3.6546 3.0587 0.6040 H 1 UNL1111111111 0.3527 @BOND 1 1 13 1 2 1 16 1 3 2 15 1 4 2 29 1 5 3 15 2 6 4 7 ar 7 4 8 ar 8 4 17 1 9 5 6 ar 10 5 8 ar 11 5 9 1 12 6 7 ar 13 6 10 ar 14 7 11 ar 15 8 12 1 16 9 15 1 17 9 18 1 18 9 19 1 19 10 13 ar 20 10 20 1 21 11 14 ar 22 11 21 1 23 12 22 1 24 12 23 1 25 12 24 1 26 13 14 ar 27 14 25 1 28 16 26 1 29 16 27 1 30 16 28 1