B16HKB -OEChem-04012112432D 28 28 0 1 0 0 0 0 0999 V2000 4.9444 -1.9089 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2045 -3.1690 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 2.5543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7579 -0.0818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1756 0.6226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.2588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3566 -1.0999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6354 -2.8600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4444 -3.4478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.5362 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5768 1.6407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -0.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9444 -1.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8135 4.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2534 -2.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9657 1.4714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5336 1.0222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1784 1.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 0.5578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 3.3236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -1.1647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6002 2.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3151 4.4322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 4.5694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3119 3.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4444 -4.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 17 2 0 0 0 0 3 12 1 0 0 0 0 3 24 1 0 0 0 0 4 13 2 0 0 0 0 5 14 2 0 0 0 0 11 6 1 6 0 0 0 6 14 1 0 0 0 0 6 21 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 7 22 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 17 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$