BY9E4T -OEChem-04022114263D 45 47 0 1 0 0 0 0 0999 V2000 -1.3798 -1.5708 -1.1744 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4264 2.6552 -0.8566 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5078 0.6715 0.5385 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2005 1.6887 1.4518 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1497 -1.9604 -2.5531 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -1.9224 -0.5078 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6156 0.7982 -0.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0984 0.0995 -1.0011 N 0 0 1 0 0 0 0 0 0 0 0 0 0.7528 1.5101 -0.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5369 1.9684 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4134 0.7261 0.3074 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2139 0.6339 -1.4828 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8634 1.0600 0.2899 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7361 2.4027 -1.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3393 1.3611 1.4652 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7573 2.6295 -0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 1.5722 0.8582 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0504 -2.2216 -0.2084 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2305 -2.4616 1.1538 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1798 -2.4921 -0.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5753 2.0681 1.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8196 -2.9718 1.9171 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.0024 -0.0444 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0499 -3.2422 1.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9937 2.8048 -0.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3787 2.3047 1.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1905 0.0617 1.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0033 1.2412 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9251 -0.1311 -1.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9171 3.1323 -2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8257 1.4055 -1.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4383 0.7103 2.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8903 2.3007 1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7636 2.6480 -0.6793 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5803 3.6117 0.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4207 1.8693 1.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0807 0.6227 0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1804 -2.2640 1.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3424 -2.3322 -1.8693 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8414 2.7758 0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2172 1.1829 1.5283 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7119 2.5564 2.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6793 -3.1594 2.9776 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -3.2161 -0.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8674 -3.6399 1.9121 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 8 1 0 0 0 0 1 18 1 0 0 0 0 2 9 1 0 0 0 0 2 14 1 0 0 0 0 3 9 1 0 0 0 0 3 15 1 0 0 0 0 4 13 1 0 0 0 0 4 21 1 0 0 0 0 7 13 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 19 38 1 0 0 0 0 20 23 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 24 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M END $$$$