BBG9N3 -OEChem-04022110202D 60 63 0 1 0 0 0 0 0999 V2000 5.4641 0.4470 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.4470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -0.4190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.3130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 -1.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5202 -0.5530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.0530 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2583 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6477 -0.9453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0463 -1.6356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 0.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 0.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 -2.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 -2.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7908 0.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9938 0.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1292 0.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1292 -1.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -0.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -0.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 1.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 1.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 1.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 2.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 27 1 0 0 0 0 2 19 2 0 0 0 0 3 22 2 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 44 1 0 0 0 0 7 16 1 0 0 0 0 7 19 1 0 0 0 0 7 45 1 0 0 0 0 8 18 2 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 17 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 24 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 56 1 0 0 0 0 30 32 2 0 0 0 0 30 57 1 0 0 0 0 31 33 2 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 M END $$$$