B9IUJ2 -OEChem-04042106023D 40 43 0 1 0 0 0 0 0999 V2000 -5.9860 3.0016 0.2415 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.8995 -2.2489 -1.1182 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1828 1.7624 0.2425 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1975 -1.2167 0.1094 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -0.6550 0.0676 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1917 -2.6878 -0.3339 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2897 -1.8456 -0.3278 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9746 0.4874 -0.1826 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2842 2.6277 0.2372 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3021 -2.3924 0.0186 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7017 -0.0721 0.9011 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6086 0.4435 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1229 -1.9562 -0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5052 -3.3254 1.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8581 -0.6272 -0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4751 -1.3018 -0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3959 -0.1724 -0.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 0.5226 -0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4162 0.8687 -1.2018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2504 -0.1411 0.8284 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2908 1.9411 -1.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 0.9314 1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3028 1.8020 -0.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1452 1.9725 0.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6853 2.2816 -0.1224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5575 -2.9472 -0.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5563 -0.4295 1.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4256 0.7438 0.9456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4448 0.9483 -0.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0579 1.1350 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2435 -2.8362 2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1179 -4.2219 1.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5502 -3.6455 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 0.8544 -2.0636 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2422 -0.9470 1.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3068 2.7519 -1.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7904 0.9563 1.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3731 1.4573 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0028 2.7506 0.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7818 3.0173 -0.9269 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 16 2 0 0 0 0 3 9 1 0 0 0 0 3 18 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 16 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 15 2 0 0 0 0 8 18 2 0 0 0 0 8 23 1 0 0 0 0 9 23 2 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 24 2 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$