@MOLECULE bufotenin 31 32 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.8191 -2.8115 -0.0261 O.3 1 UNL1111111111 -0.3284 2 N 3.7351 -0.2513 0.0086 N.3 1 UNL1111111111 -0.1529 3 N -1.4485 2.4848 -0.0845 N.ar 1 UNL1111111111 -0.6276 4 C 1.5826 0.5724 0.8723 C.3 1 UNL1111111111 -0.4556 5 C 0.2553 1.0868 0.4830 C.ar 1 UNL1111111111 -0.1350 6 C -0.9098 0.2857 0.2320 C.ar 1 UNL1111111111 0.0545 7 C 2.3468 0.0939 -0.3848 C.3 1 UNL1111111111 -0.2171 8 C -1.9652 1.1874 -0.1219 C.ar 1 UNL1111111111 0.3011 9 C -0.1050 2.4128 0.2846 C.ar 1 UNL1111111111 -0.1309 10 C -1.1636 -1.0904 0.2736 C.ar 1 UNL1111111111 -0.4251 11 C -3.2591 0.7420 -0.4329 C.ar 1 UNL1111111111 -0.4600 12 C -2.4482 -1.4996 -0.0357 C.ar 1 UNL1111111111 0.0826 13 C 4.6417 -0.1756 -1.1584 C.3 1 UNL1111111111 -0.7975 14 C 3.7985 -1.5979 0.6165 C.3 1 UNL1111111111 -0.7512 15 C -3.4975 -0.6148 -0.3880 C.ar 1 UNL1111111111 -0.1265 16 H 2.1873 1.3452 1.3920 H 1 UNL1111111111 0.2134 17 H 1.4838 -0.2566 1.6016 H 1 UNL1111111111 0.2588 18 H 2.3706 0.9217 -1.1261 H 1 UNL1111111111 0.1873 19 H 1.8037 -0.7457 -0.8648 H 1 UNL1111111111 0.1767 20 H 0.4946 3.2986 0.3775 H 1 UNL1111111111 0.2394 21 H -1.9572 3.3123 -0.2788 H 1 UNL1111111111 0.4504 22 H -0.3784 -1.7859 0.5402 H 1 UNL1111111111 0.2729 23 H -4.0418 1.4457 -0.6980 H 1 UNL1111111111 0.2431 24 H 4.6530 0.8608 -1.5348 H 1 UNL1111111111 0.2459 25 H 4.3770 -0.8480 -1.9871 H 1 UNL1111111111 0.2519 26 H 5.6683 -0.4107 -0.8333 H 1 UNL1111111111 0.2856 27 H 4.8287 -1.7885 0.9587 H 1 UNL1111111111 0.2726 28 H 3.4966 -2.4156 -0.0541 H 1 UNL1111111111 0.2658 29 H 3.1520 -1.6212 1.5092 H 1 UNL1111111111 0.2579 30 H -4.4760 -1.0323 -0.6160 H 1 UNL1111111111 0.2236 31 H -2.0692 -3.4029 0.2194 H 1 UNL1111111111 0.3244 @BOND 1 1 12 1 2 1 31 1 3 2 7 1 4 2 13 1 5 2 14 1 6 3 8 ar 7 3 9 ar 8 3 21 1 9 4 5 1 10 4 7 1 11 4 16 1 12 4 17 1 13 5 6 ar 14 5 9 ar 15 6 8 ar 16 6 10 ar 17 7 18 1 18 7 19 1 19 8 11 ar 20 9 20 1 21 10 12 ar 22 10 22 1 23 11 15 ar 24 11 23 1 25 12 15 ar 26 13 24 1 27 13 25 1 28 13 26 1 29 14 27 1 30 14 28 1 31 14 29 1 32 15 30 1