B6W3RO -OEChem-04022107542D 54 57 0 0 0 0 0 0 0999 V2000 8.9204 -0.9773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6486 -1.9839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0506 -2.5114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5204 -0.4873 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0506 0.4886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1845 -1.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1845 -2.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3845 -0.9906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2906 -0.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0506 -0.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2906 -2.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3845 -2.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9166 -2.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9166 -1.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6525 -0.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7826 -2.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 0.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0564 -0.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0602 0.5261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1884 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 1.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3243 -0.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 2.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 2.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2978 0.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2978 -3.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8488 -2.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4535 -0.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5228 0.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4726 -3.0484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3195 -2.8214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0926 -1.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1887 -0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3917 -0.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5875 0.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5136 0.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 0.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9928 0.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5983 0.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 -1.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1985 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7862 -0.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 2.3507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 3.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 0.7415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 2.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 19 1 0 0 0 0 2 22 1 0 0 0 0 3 16 2 0 0 0 0 4 8 2 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 36 1 0 0 0 0 6 11 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 32 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 35 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 27 2 0 0 0 0 21 28 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END $$$$