BO1VA0 -OEChem-04022107272D 56 58 0 0 0 0 0 0 0999 V2000 4.5981 5.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -6.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -6.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 0.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -7.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 7.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 1 33 1 0 0 0 0 2 20 1 0 0 0 0 3 17 2 0 0 0 0 4 22 2 0 0 0 0 7 12 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 22 1 0 0 0 0 11 25 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 35 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 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 23 45 1 0 0 0 0 24 27 2 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 29 2 0 0 0 0 26 31 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M CHG 2 7 -1 12 1 M END $$$$