BP3B5K -OEChem-04022109192D 44 46 0 1 0 0 0 0 0999 V2000 3.0981 -1.5981 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.9641 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -5.3301 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -3.5981 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -2.4641 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 2.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 5.3301 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.9641 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9641 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.4641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.9641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.4641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 1.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -2.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 -1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 -1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -2.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -3.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6807 -1.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9904 -0.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -0.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2181 -0.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4081 0.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.0841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.1541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4081 4.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2181 2.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 20 1 0 0 0 0 3 20 1 0 0 0 0 4 20 1 0 0 0 0 5 23 1 0 0 0 0 6 28 1 0 0 0 0 7 32 1 0 0 0 0 8 32 1 0 0 0 0 9 32 1 0 0 0 0 10 17 1 0 0 0 0 10 21 1 0 0 0 0 11 24 1 0 0 0 0 11 27 1 0 0 0 0 12 15 1 0 0 0 0 12 21 2 0 0 0 0 13 21 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 27 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 6 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 20 1 6 0 0 0 17 35 1 0 0 0 0 18 22 1 0 0 0 0 18 23 2 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 2 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 M END $$$$