B4MJU2 -OEChem-04012114492D 28 30 0 0 0 0 0 0 0999 V2000 2.8660 1.9470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -1.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2010 0.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2010 -1.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 -0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.9840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.9101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 2 19 1 0 0 0 0 3 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 13 2 0 0 0 0 9 18 1 0 0 0 0 10 15 1 0 0 0 0 10 20 1 0 0 0 0 11 16 2 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$