B71WOI -OEChem-04022102433D 52 55 0 0 0 0 0 0 0999 V2000 1.4878 0.6256 1.0631 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7464 -0.9227 -2.0103 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7724 -2.5041 -0.3778 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 1.4122 0.8324 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7621 1.1578 0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9527 0.4694 -0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4864 2.4172 -0.5113 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2285 -0.8337 0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5806 2.0440 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8268 -2.0002 -0.3599 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2193 2.9129 -0.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7302 2.2068 1.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 1.0647 -1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4406 2.9938 -1.3842 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -1.9555 -1.6643 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6227 2.3137 -1.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9079 -0.9116 1.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0561 1.6172 1.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1046 -3.2448 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1664 0.8100 0.8991 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1857 -2.1563 2.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -3.3230 1.4209 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0025 -2.2938 -2.8439 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6174 -0.3516 1.5261 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7439 1.2240 -0.3012 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6459 -1.0992 0.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7724 0.4764 -0.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2235 -0.6851 -0.2477 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2966 -1.4642 -0.8452 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8033 3.8695 -0.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6395 1.9391 2.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0105 3.2680 1.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8021 0.5567 -1.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2578 3.9717 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 -2.6813 -1.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6073 -0.9954 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5379 0.4249 0.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3468 2.7668 -2.3599 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2288 -0.0129 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3445 2.6761 1.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9641 1.3559 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 -4.1625 -0.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7146 -2.2172 3.0181 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0001 -4.2920 1.8611 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -3.2990 -2.7499 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4334 -2.2559 -3.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8328 -1.5845 -2.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1751 -0.6870 2.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4009 2.1276 -0.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9827 -2.0014 1.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1938 0.8350 -1.8095 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4697 -1.4552 -2.4049 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 29 2 0 0 0 0 4 12 1 0 0 0 0 4 18 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 8 1 0 0 0 0 6 13 2 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 17 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 15 1 0 0 0 0 10 19 2 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 16 2 0 0 0 0 14 34 1 0 0 0 0 15 23 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 38 1 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 25 27 2 0 0 0 0 25 49 1 0 0 0 0 26 28 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 M END $$$$