B6PSZ9 -OEChem-04022118443D 38 39 0 1 0 0 0 0 0999 V2000 0.1378 -1.0482 -0.0144 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2263 -1.9977 -1.9338 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -3.6408 -0.4271 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3347 0.8476 1.6544 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8281 3.0668 0.4294 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7863 2.2946 -1.4531 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2426 -0.0630 -0.2003 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5419 -0.9480 0.6338 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0207 0.3167 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1817 -1.1358 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8969 -1.3474 0.3555 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5500 -1.3135 1.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3168 0.4275 -0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3296 -2.0872 0.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2418 1.4740 0.4174 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0958 -0.7297 -0.4649 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -1.9782 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7957 1.6922 -0.6813 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7336 2.7224 0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9648 -2.4528 -0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0081 2.8313 -0.5128 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 0.9062 0.5048 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1625 2.1630 -0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0061 -0.4034 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1163 -2.1166 1.7173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6754 -1.5886 1.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3984 -2.2680 1.5982 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5563 -0.5206 1.8379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9649 -3.0696 0.7539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2458 1.4550 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0948 -0.6683 -0.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2166 -2.8654 -0.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 1.8011 -1.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9515 0.1375 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1224 3.6104 0.1683 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3905 3.8036 -0.8094 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2721 -2.7272 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0527 2.7883 1.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 20 1 0 0 0 0 2 37 1 0 0 0 0 3 20 2 0 0 0 0 4 22 2 0 0 0 0 5 23 1 0 0 0 0 5 38 1 0 0 0 0 6 23 2 0 0 0 0 7 11 1 0 0 0 0 7 22 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 9 13 1 0 0 0 0 9 15 2 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 14 17 1 0 0 0 0 14 29 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$