BS1N7R -OEChem-04022100402D 49 52 0 1 0 0 0 0 0999 V2000 2.8660 0.4219 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5782 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.4219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 -0.8829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 -0.0781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6724 3.5782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0782 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1962 -1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 0.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0511 1.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3833 2.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0296 1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6939 3.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3403 2.8338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 1.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 0.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 1.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 1.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -1.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -1.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7766 2.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4437 1.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2799 3.8334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9470 2.9617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 25 1 0 0 0 0 3 16 2 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 17 2 0 0 0 0 15 8 1 6 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 28 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 15 38 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 26 1 0 0 0 0 22 25 2 0 0 0 0 22 43 1 0 0 0 0 23 28 1 0 0 0 0 23 44 1 0 0 0 0 24 29 2 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$