B3V8WU -OEChem-04022109403D 51 54 0 0 0 0 0 0 0999 V2000 4.5760 1.3156 1.4823 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1536 -3.4387 1.2511 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4127 -2.3282 1.9321 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1531 -4.1955 0.8601 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.9001 1.0386 2.2192 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3998 -1.1468 1.8434 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3712 2.4029 -0.9811 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 0.2401 -1.8106 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8938 2.0839 -0.6969 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2504 2.8538 -0.1571 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0642 1.5558 -1.5687 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4296 -0.1038 -1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -0.6356 -2.7121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0532 2.2561 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7527 1.0638 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6708 -1.1433 -2.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6959 3.3647 -1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1332 -1.2994 -0.8954 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8397 1.0566 0.5324 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5606 -0.1327 0.6972 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2119 -1.2888 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6817 -1.8389 -0.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8646 -0.9162 -2.8307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8864 -2.3077 -0.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0692 -1.3848 -2.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0803 -2.0807 -1.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6899 -0.1625 1.6142 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8986 -3.0514 0.8802 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5627 2.4083 -0.0567 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 1.8855 1.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2323 1.7797 2.4266 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 1.2238 3.4992 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2786 0.9256 3.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4775 -0.0845 -3.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2712 -1.4874 -2.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3261 2.7096 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8517 1.5745 -2.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4851 3.8594 -1.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0469 4.1231 -1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8673 -2.2010 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0816 1.9725 1.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7758 -2.2097 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2415 -2.0312 -0.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -0.3790 -3.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6338 2.8178 0.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9987 -1.2075 -2.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0293 -2.4362 -0.7061 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1968 2.0776 2.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6629 1.0084 2.8353 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6032 1.0507 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0614 0.4971 3.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 33 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 27 1 0 0 0 0 5 49 1 0 0 0 0 6 27 2 0 0 0 0 7 29 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 15 1 0 0 0 0 10 17 1 0 0 0 0 10 29 1 0 0 0 0 10 45 1 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 18 1 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 16 22 2 0 0 0 0 16 23 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 21 2 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END $$$$