BA9FH1 -OEChem-04012113142D 27 29 0 0 0 0 0 0 0999 V2000 5.0274 2.5722 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6589 -1.6341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2559 -0.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.0334 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1391 1.0348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 1.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 1.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 2.5722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 0.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 1.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8311 0.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 3.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2506 -0.7213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 3.1483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0726 -2.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 -3.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 0.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1955 -0.4120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 3.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 3.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6411 -1.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5592 -2.7917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 -3.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -3.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0468 -3.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 13 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 5 7 2 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 8 12 2 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 12 15 1 0 0 0 0 12 20 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$