B3HP2N -OEChem-04012116492D 40 42 0 0 0 0 0 0 0999 V2000 5.4641 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4050 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.0622 2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 -1.1297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9050 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8660 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 0.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 0.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -1.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -1.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 1.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 0.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 -0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 16 1 0 0 0 0 2 38 1 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 18 1 0 0 0 0 6 23 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 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 29 1 0 0 0 0 11 30 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 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M CHG 2 3 -1 7 1 M END $$$$