B3J5QU -OEChem-04022118123D 22 22 0 1 0 0 0 0 0999 V2000 1.7393 0.1050 -0.1135 P 0 0 1 0 0 0 0 0 0 0 0 0 2.1502 -1.3540 -0.6948 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5327 1.2067 -0.7589 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8311 -0.0221 -0.3183 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6929 -1.2355 -0.1559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 0.0978 -0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1612 -1.1762 0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2138 1.2335 0.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7129 1.2277 0.0854 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1938 -0.0829 1.6138 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6291 -1.5863 -1.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1772 -1.9706 0.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6678 -2.0946 -0.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2359 -1.1311 1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5396 1.4707 1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5787 2.0357 -0.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2012 2.1801 0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8166 -0.0229 -0.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6912 -0.9435 2.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2737 -0.2325 1.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9235 0.8136 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -1.6398 -0.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 2 22 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 9 2 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 M END $$$$