BUP9K7 -OEChem-04022101412D 39 42 0 0 0 0 0 0 0999 V2000 4.6660 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 12 1 0 0 0 0 3 13 2 0 0 0 0 4 16 1 0 0 0 0 4 21 2 0 0 0 0 5 8 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 9 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 19 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$