BD2EW3 -OEChem-04022109172D 53 55 0 1 0 0 0 0 0999 V2000 3.3660 -6.6292 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.2631 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -4.8971 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -3.7631 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 -2.0311 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 6.6292 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9641 6.2631 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 5.2631 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.7631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 4.0311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.2631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.7631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.2990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 2.2990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -4.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.2631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 -2.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -2.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 -2.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -2.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 -1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 5.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -4.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.8831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -2.5871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 -2.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 -3.2071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -2.0311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4081 -0.6281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.3831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.4531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -0.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5611 0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 0.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9081 3.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 4.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 5.2956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 22 1 0 0 0 0 3 22 1 0 0 0 0 4 25 1 0 0 0 0 5 27 1 0 0 0 0 6 36 1 0 0 0 0 7 36 1 0 0 0 0 8 36 1 0 0 0 0 9 19 1 0 0 0 0 9 23 1 0 0 0 0 10 29 2 0 0 0 0 11 33 1 0 0 0 0 11 35 1 0 0 0 0 12 17 1 0 0 0 0 12 23 2 0 0 0 0 13 23 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 26 1 0 0 0 0 14 29 1 0 0 0 0 14 47 1 0 0 0 0 15 30 2 0 0 0 0 15 34 1 0 0 0 0 16 31 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 6 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 22 1 6 0 0 0 19 39 1 0 0 0 0 20 24 1 0 0 0 0 20 25 2 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 24 26 2 0 0 0 0 24 43 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 28 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 33 34 2 0 0 0 0 34 51 1 0 0 0 0 35 36 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 M END $$$$