BU95EF -OEChem-04012116502D 32 34 0 0 0 0 0 0 0999 V2000 5.4641 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4050 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.0622 2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 -1.1297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9050 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -1.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 0.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6494 -1.7490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1244 -2.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3397 -2.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 -1.7490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 1.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 0.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 -0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 15 1 0 0 0 0 2 31 1 0 0 0 0 3 8 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 27 1 0 0 0 0 6 12 3 0 0 0 0 7 17 1 0 0 0 0 7 22 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 16 19 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 32 1 0 0 0 0 M CHG 2 3 -1 8 1 M END $$$$