@MOLECULE 4,4'-diacetoxybenzhydrylidenecyclohexane 51 53 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.7422 1.9949 0.4907 O.3 1 UNL1111111111 -0.4208 2 O 4.5903 2.3101 0.1056 O.3 1 UNL1111111111 -0.4251 3 O -6.1030 0.6682 -0.7335 O.2 1 UNL1111111111 -0.4806 4 O 6.0069 0.5779 -0.1928 O.2 1 UNL1111111111 -0.4773 5 C 0.3083 -5.0064 0.3177 C.3 1 UNL1111111111 -0.2697 6 C 1.4845 -4.0288 0.4353 C.3 1 UNL1111111111 -0.2504 7 C -1.0157 -4.2519 0.4864 C.3 1 UNL1111111111 -0.2526 8 C 1.3614 -2.9403 -0.6423 C.3 1 UNL1111111111 -0.2934 9 C -1.1374 -3.0984 -0.5252 C.3 1 UNL1111111111 -0.2905 10 C 0.0673 -2.2098 -0.4471 C.2 1 UNL1111111111 0.0698 11 C 0.0023 -0.8883 -0.2139 C.2 1 UNL1111111111 -0.1371 12 C -1.2629 -0.1604 -0.0488 C.ar 1 UNL1111111111 -0.0102 13 C 1.1999 -0.0426 -0.1067 C.ar 1 UNL1111111111 -0.0035 14 C -2.1029 0.0358 -1.1487 C.ar 1 UNL1111111111 -0.1284 15 C 2.0978 -0.2345 0.9490 C.ar 1 UNL1111111111 -0.1310 16 C -1.6126 0.3458 1.2075 C.ar 1 UNL1111111111 -0.1184 17 C 1.4430 0.9401 -1.0722 C.ar 1 UNL1111111111 -0.1207 18 C -3.3003 0.7310 -1.0031 C.ar 1 UNL1111111111 -0.2108 19 C 3.2631 0.5222 1.0247 C.ar 1 UNL1111111111 -0.2021 20 C -2.8070 1.0374 1.3748 C.ar 1 UNL1111111111 -0.2092 21 C 2.6006 1.7094 -1.0116 C.ar 1 UNL1111111111 -0.2046 22 C -3.6279 1.2163 0.2598 C.ar 1 UNL1111111111 0.2275 23 C 3.4913 1.4741 0.0344 C.ar 1 UNL1111111111 0.2250 24 C -5.9503 1.6390 -0.0469 C.2 1 UNL1111111111 0.6315 25 C 5.8358 1.7522 -0.0206 C.2 1 UNL1111111111 0.6284 26 C -6.9667 2.6394 0.3809 C.3 1 UNL1111111111 -0.5105 27 C 6.8529 2.8337 0.0845 C.3 1 UNL1111111111 -0.5112 28 H 0.3337 -5.5169 -0.6632 H 1 UNL1111111111 0.1358 29 H 0.3933 -5.8038 1.0775 H 1 UNL1111111111 0.1297 30 H 2.4455 -4.5582 0.3352 H 1 UNL1111111111 0.1328 31 H 1.4929 -3.5627 1.4393 H 1 UNL1111111111 0.1392 32 H -1.0880 -3.8485 1.5146 H 1 UNL1111111111 0.1401 33 H -1.8683 -4.9441 0.3681 H 1 UNL1111111111 0.1315 34 H 1.3854 -3.3981 -1.6533 H 1 UNL1111111111 0.1514 35 H 2.2404 -2.2672 -0.6108 H 1 UNL1111111111 0.1576 36 H -2.0768 -2.5397 -0.3363 H 1 UNL1111111111 0.1559 37 H -1.2341 -3.5040 -1.5529 H 1 UNL1111111111 0.1501 38 H -1.8188 -0.3585 -2.1237 H 1 UNL1111111111 0.1599 39 H 1.8868 -0.9888 1.7062 H 1 UNL1111111111 0.1597 40 H -0.9442 0.1942 2.0545 H 1 UNL1111111111 0.1614 41 H 0.7242 1.0950 -1.8763 H 1 UNL1111111111 0.1627 42 H -3.9663 0.8798 -1.8500 H 1 UNL1111111111 0.1764 43 H 3.9844 0.3694 1.8223 H 1 UNL1111111111 0.1680 44 H -3.1008 1.4369 2.3414 H 1 UNL1111111111 0.1686 45 H 2.8141 2.4723 -1.7547 H 1 UNL1111111111 0.1680 46 H -7.6918 2.1802 1.0727 H 1 UNL1111111111 0.1882 47 H -7.5328 3.0124 -0.4878 H 1 UNL1111111111 0.1873 48 H -6.5224 3.5079 0.8939 H 1 UNL1111111111 0.1887 49 H 7.4266 2.9160 -0.8531 H 1 UNL1111111111 0.1877 50 H 7.5715 2.6124 0.8902 H 1 UNL1111111111 0.1868 51 H 6.4076 3.8203 0.2917 H 1 UNL1111111111 0.1885 @BOND 1 1 22 1 2 1 24 1 3 2 23 1 4 2 25 1 5 3 24 2 6 4 25 2 7 5 6 1 8 5 7 1 9 5 28 1 10 5 29 1 11 6 8 1 12 6 30 1 13 6 31 1 14 7 9 1 15 7 32 1 16 7 33 1 17 8 10 1 18 8 34 1 19 8 35 1 20 9 10 1 21 9 36 1 22 9 37 1 23 10 11 2 24 11 12 1 25 11 13 1 26 12 14 ar 27 12 16 ar 28 13 15 ar 29 13 17 ar 30 14 18 ar 31 14 38 1 32 15 19 ar 33 15 39 1 34 16 20 ar 35 16 40 1 36 17 21 ar 37 17 41 1 38 18 22 ar 39 18 42 1 40 19 23 ar 41 19 43 1 42 20 22 ar 43 20 44 1 44 21 23 ar 45 21 45 1 46 24 26 1 47 25 27 1 48 26 46 1 49 26 47 1 50 26 48 1 51 27 49 1 52 27 50 1 53 27 51 1