BW0C2B -OEChem-04042104133D 37 39 0 0 0 0 0 0 0999 V2000 5.5017 1.2969 0.1553 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7574 0.8609 -0.4395 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8862 2.5407 -0.2861 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0999 -2.1963 -0.4197 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6783 -0.4397 -0.1432 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2294 0.8187 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0978 0.7695 -0.0389 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6847 1.3480 1.8534 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8824 -1.1782 1.7901 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0378 -0.7277 -0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3345 0.0100 -0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9703 0.3005 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4694 -2.0468 -0.2878 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3461 -1.3273 -0.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4662 -0.5376 -0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7662 -1.3088 -0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0041 -0.0514 -0.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8337 -2.3372 -0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8878 -0.9848 -0.2763 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9631 -0.1579 0.8163 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1024 0.9630 -1.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0206 0.7500 0.8713 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 1.8709 -1.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1191 1.7645 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6517 1.3329 0.1075 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7904 -2.8859 -0.3968 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2391 -2.3955 -0.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8234 -1.5589 -0.1559 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1706 -3.3642 -0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3685 1.0566 -1.9396 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7751 0.6786 1.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2377 2.6597 -1.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5703 1.0084 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2904 2.1555 2.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9427 2.4713 -0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5867 -1.2386 2.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 -1.8474 1.7749 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 7 15 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 20 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 25 1 0 0 0 0 13 18 2 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 18 29 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 22 24 1 0 0 0 0 22 31 1 0 0 0 0 23 24 2 0 0 0 0 23 32 1 0 0 0 0 24 35 1 0 0 0 0 M END $$$$