BU4RE6 -OEChem-04012117192D 44 47 0 1 0 0 0 0 0999 V2000 9.2619 -2.0005 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 1.4636 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -0.2685 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.2685 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.2619 1.4636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7315 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -0.2685 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2619 -0.2685 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7619 0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.5976 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7619 -1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9519 -0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5719 -0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 1.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 0.8096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 -1.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -1.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 -1.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 -1.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -1.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 -1.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 0.8455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 1.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 2.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 1.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -1.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 22 1 0 0 0 0 3 24 1 0 0 0 0 8 4 1 6 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 11 5 1 6 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 18 2 0 0 0 0 6 25 1 0 0 0 0 7 21 1 0 0 0 0 7 25 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 1 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 18 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 19 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 19 23 2 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$