BJC3A4 -OEChem-04012120312D 33 34 0 0 0 0 0 0 0999 V2000 7.1962 0.5600 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 14 1 0 0 0 0 2 14 2 0 0 0 0 3 16 2 0 0 0 0 4 21 2 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 26 1 0 0 0 0 6 13 1 0 0 0 0 6 17 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 10 12 2 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 16 20 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END $$$$