BA2W5K -OEChem-04022110043D 28 30 0 0 0 0 0 0 0999 V2000 4.7010 0.1427 -0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -0.2746 -0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -2.0414 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5793 -1.3302 0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9611 1.4860 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0317 0.2127 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2371 0.8739 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7855 -1.1609 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.1153 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3703 0.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8109 -2.1137 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 0.1894 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.2180 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4063 -0.2830 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1284 -1.6477 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0112 2.4483 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6173 -0.8145 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9189 1.5521 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0449 -2.2272 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5273 1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5951 -3.1769 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0677 3.0372 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9435 -2.3677 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3938 3.4646 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0024 1.7110 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5288 2.0206 0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5286 2.0208 -0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5649 -0.9672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 2 28 1 0 0 0 0 3 17 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 19 1 0 0 0 0 5 12 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 10 20 1 0 0 0 0 11 15 2 0 0 0 0 11 21 1 0 0 0 0 12 17 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$