@MOLECULE 6-amino-6,7,8,9-tetrahydro-5h-benzo[7]annulene-1,2-diol 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.3278 -1.8027 -0.0180 O.3 1 UNL1111111111 -0.2122 2 O -3.7866 0.2997 -0.4734 O.3 1 UNL1111111111 -0.2387 3 N 3.8505 1.1398 -0.3779 N.3 1 UNL1111111111 -0.9783 4 C 2.5414 0.4370 -0.4156 C.3 1 UNL1111111111 0.3810 5 C 2.8067 -1.0733 -0.2456 C.3 1 UNL1111111111 -0.6455 6 C 1.6775 0.9999 0.7404 C.3 1 UNL1111111111 -0.9345 7 C 1.5393 -1.9098 -0.4406 C.3 1 UNL1111111111 -0.1824 8 C 0.5065 -1.6763 0.6748 C.3 1 UNL1111111111 -0.7587 9 C 0.2233 0.8171 0.4414 C.ar 1 UNL1111111111 0.2535 10 C -0.3339 -0.4722 0.3910 C.ar 1 UNL1111111111 0.0546 11 C -1.6845 -0.6100 0.0726 C.ar 1 UNL1111111111 -0.0447 12 C -0.5704 1.9348 0.2012 C.ar 1 UNL1111111111 -0.2569 13 C -2.4813 0.5295 -0.1724 C.ar 1 UNL1111111111 0.0153 14 C -1.9265 1.8001 -0.1032 C.ar 1 UNL1111111111 -0.3837 15 H 2.0101 0.6128 -1.3864 H 1 UNL1111111111 0.1215 16 H 3.2499 -1.2609 0.7519 H 1 UNL1111111111 0.2918 17 H 3.5765 -1.4003 -0.9710 H 1 UNL1111111111 0.2064 18 H 1.9236 2.0678 0.9093 H 1 UNL1111111111 0.3201 19 H 1.9542 0.5055 1.6941 H 1 UNL1111111111 0.3338 20 H 1.8150 -2.9821 -0.4678 H 1 UNL1111111111 0.1692 21 H 1.0838 -1.6895 -1.4257 H 1 UNL1111111111 0.1774 22 H 1.0239 -1.5520 1.6514 H 1 UNL1111111111 0.2969 23 H -0.1125 -2.5884 0.8055 H 1 UNL1111111111 0.2750 24 H -0.1362 2.9316 0.2497 H 1 UNL1111111111 0.2089 25 H 3.7595 2.1190 -0.5893 H 1 UNL1111111111 0.3637 26 H 4.5233 0.7308 -1.0029 H 1 UNL1111111111 0.3642 27 H -2.5352 2.6805 -0.2846 H 1 UNL1111111111 0.2443 28 H -1.6981 -2.5620 0.1028 H 1 UNL1111111111 0.2671 29 H -4.2731 1.1490 -0.6184 H 1 UNL1111111111 0.2907 @BOND 1 1 11 1 2 1 28 1 3 2 13 1 4 2 29 1 5 3 4 1 6 3 25 1 7 3 26 1 8 4 5 1 9 4 6 1 10 4 15 1 11 5 7 1 12 5 16 1 13 5 17 1 14 6 9 1 15 6 18 1 16 6 19 1 17 7 8 1 18 7 20 1 19 7 21 1 20 8 10 1 21 8 22 1 22 8 23 1 23 9 10 ar 24 9 12 ar 25 10 11 ar 26 11 13 ar 27 12 14 ar 28 12 24 1 29 13 14 ar 30 14 27 1