D0E1BR -OEChem-10191521572D 41 42 0 1 0 0 0 0 0999 V2000 5.4641 4.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4641 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8301 2.1340 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8301 3.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 13 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 10 2 0 0 0 0 2 13 1 0 0 0 0 3 18 1 0 0 0 0 4 27 1 0 0 0 0 11 19 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 24 39 1 0 0 0 0 25 27 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 M CHG 3 5 -1 8 -1 9 -1 M END $$$$