BU43OX -OEChem-04022113333D 29 31 0 1 0 0 0 0 0999 V2000 4.3444 -0.9018 -1.3528 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1372 0.5297 -1.2414 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5839 -0.4327 -0.6075 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 0.2688 0.8059 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2717 1.0990 -0.2239 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3361 0.0213 0.3780 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2833 1.4874 0.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1013 -1.1993 0.9507 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -0.8133 1.5861 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -0.0054 -0.5586 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9137 -0.2227 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3938 1.0751 -0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7873 -1.3068 -0.2698 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7477 1.2889 0.0816 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1411 -1.0931 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6214 0.2047 0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7264 1.9476 -0.6452 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1924 0.4829 1.2252 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9238 2.3095 0.4868 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8775 1.7167 1.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2789 -1.9166 0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -1.7375 1.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3237 -0.4663 2.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1297 -1.6758 1.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 1.9311 -0.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4186 -2.3198 -0.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 2.2995 0.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8214 -1.9373 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6756 0.3711 0.3662 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 15 2 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 M END $$$$