BBO8W4 -OEChem-04012113252D 44 48 0 0 0 0 0 0 0999 V2000 10.0883 -2.0827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.9627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 1.7675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.4627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 1.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6051 -1.0091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9989 -0.2043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 1.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 3.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 0.1580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5298 0.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5298 1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -0.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5938 -1.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0938 -1.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6870 -2.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4302 -3.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2962 -3.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 1.8288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 2.2963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 3.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 1.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 1.2182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0826 3.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 4.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 3.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 2.2963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 4.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 3.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 0.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 0.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -0.4313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 2.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6648 1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0806 -3.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3654 -4.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8626 -3.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 18 2 0 0 0 0 4 7 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 18 1 0 0 0 0 5 20 2 0 0 0 0 6 19 2 0 0 0 0 6 21 1 0 0 0 0 7 21 2 0 0 0 0 8 20 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$