BD0PY2 -OEChem-04012115202D 39 40 0 1 0 0 0 0 0999 V2000 5.4641 1.1830 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8170 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.1830 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.4510 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6830 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 2.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 3.7200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 24 1 0 0 0 0 3 24 1 0 0 0 0 4 24 1 0 0 0 0 7 23 1 0 0 0 0 7 39 1 0 0 0 0 8 23 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 23 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 17 2 0 0 0 0 13 28 1 0 0 0 0 14 21 1 0 0 0 0 14 29 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$