DR1391 -OEChem-05042003183D 40 42 0 1 0 0 0 0 0999 V2000 3.4422 -2.3525 -0.0816 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0171 -1.0917 -0.9227 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0693 0.8849 -0.1634 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1069 1.0635 -0.1113 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2803 0.5054 0.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 2.5734 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4746 2.8248 0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 1.5136 0.4223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9074 0.5636 -1.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7513 -0.7791 -0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0805 -2.0285 -0.5235 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1008 -1.0355 0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5302 1.2535 0.6491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2955 1.1878 -1.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1671 -3.0324 -0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0052 -0.0474 0.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8543 -0.2322 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5233 -0.2840 1.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4353 -1.4872 1.4567 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6339 0.8647 0.8305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6314 3.1952 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3861 2.8474 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2465 3.0018 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0478 3.6627 0.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0279 -0.5232 -1.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3678 0.7598 -2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1452 -2.2291 0.0052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9133 -2.0316 -1.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2048 2.0470 0.9542 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2516 2.2765 -1.4831 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8355 0.7896 -2.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9738 -3.4624 0.8531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2274 -3.8564 -0.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0522 -0.2789 0.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 1.5368 0.6128 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7437 -0.3132 2.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1048 0.6345 1.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8767 -2.4218 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8991 -1.4878 2.4478 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2321 -1.4768 0.7056 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 17 2 0 0 0 0 3 14 1 0 0 0 0 3 17 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 20 1 0 0 0 0 5 8 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 16 1 0 0 0 0 13 16 2 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 M END $$$$