B0MD1V -OEChem-04012120152D 43 45 0 0 0 0 0 0 0999 V2000 6.2619 0.2685 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -2.3296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -2.3296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 2.8665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.0732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.5363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 2.0005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7619 -0.5976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.5976 0.0000 C 0 0 0 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 8.2619 -1.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.2685 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 9.2619 -1.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.2685 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 2.8660 -0.7315 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 2.0000 0.7685 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 10.7619 1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -2.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 2.0005 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 6.1793 -0.8096 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 7.9519 0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3819 -0.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 1.6625 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 2.8660 -1.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 1.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.0785 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 8.0719 -2.8665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -2.9496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3819 -2.3296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -1.7096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5719 2.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5719 1.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 17 1 0 0 0 0 2 16 1 0 0 0 0 2 25 1 0 0 0 0 3 11 1 0 0 0 0 3 38 1 0 0 0 0 4 26 2 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 5 32 1 0 0 0 0 6 15 1 0 0 0 0 6 17 2 0 0 0 0 7 26 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 27 3 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 18 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 20 2 0 0 0 0 16 18 2 0 0 0 0 18 31 1 0 0 0 0 19 22 1 0 0 0 0 19 33 1 0 0 0 0 20 23 1 0 0 0 0 20 34 1 0 0 0 0 21 24 2 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$