BJEC27 -OEChem-04012113252D 46 48 0 0 0 0 0 0 0999 V2000 6.8671 -0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 19 2 0 0 0 0 3 29 1 0 0 0 0 3 44 1 0 0 0 0 4 30 1 0 0 0 0 4 45 1 0 0 0 0 5 29 2 0 0 0 0 6 30 2 0 0 0 0 7 31 1 0 0 0 0 7 46 1 0 0 0 0 8 31 2 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 18 2 0 0 0 0 12 15 2 0 0 0 0 12 20 1 0 0 0 0 13 19 1 0 0 0 0 13 22 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 29 1 0 0 0 0 15 33 1 0 0 0 0 16 21 1 0 0 0 0 16 30 1 0 0 0 0 17 23 1 0 0 0 0 17 34 1 0 0 0 0 18 24 1 0 0 0 0 18 35 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 26 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 25 41 1 0 0 0 0 26 28 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END $$$$