BE8IS2 -OEChem-04022105512D 39 42 0 1 0 0 0 0 0999 V2000 7.3301 1.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.5560 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -2.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -2.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.1900 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 1.0560 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5981 1.0560 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 0.0295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7585 1.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4376 1.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2056 -2.2111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3911 -4.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -4.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -2.1994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7834 -3.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9272 2.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 3 12 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 16 2 0 0 0 0 5 17 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 6 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 1 0 0 0 7 24 1 0 0 0 0 8 12 1 1 0 0 0 8 25 1 0 0 0 0 9 15 2 0 0 0 0 9 17 1 0 0 0 0 10 18 2 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 17 32 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$