BB0F5D -OEChem-04022100462D 42 45 0 1 0 0 0 0 0999 V2000 7.2458 1.9386 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 -1.6938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -0.5696 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 -0.9251 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3364 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -2.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -2.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -2.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6498 0.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -2.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6255 0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -2.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 -0.9251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9235 1.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -2.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3031 -0.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8991 1.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2788 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5768 0.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5438 2.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9570 -0.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1824 -3.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -3.4704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7513 -3.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3466 -2.7723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 -1.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 0.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0349 0.1086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 0.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -3.4806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 -0.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -3.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1184 -1.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -1.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0839 2.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6990 -0.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1817 0.8230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1356 2.7084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7285 3.4850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 3.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 22 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 2 28 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 14 18 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 16 18 2 0 0 0 0 16 34 1 0 0 0 0 17 20 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$