BWUP45 -OEChem-04022102303D 31 32 0 0 0 0 0 0 0999 V2000 1.5515 1.1491 -2.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4413 -1.8575 1.2757 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8566 2.9390 0.1349 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9667 -2.2482 -0.1958 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9758 -2.5030 -1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3115 0.2424 -0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8196 -1.8147 -0.4615 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1979 0.2237 1.2618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4143 -0.5259 -0.7509 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2645 -1.2093 1.7712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4304 -1.9268 -0.1545 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5045 1.0083 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4997 1.8240 -0.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 1.2874 0.0805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1963 -0.0001 -0.3289 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7714 2.0707 0.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4653 -0.5045 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0405 1.5665 1.0596 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3874 0.2788 0.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 0.6997 1.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 0.7884 1.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3316 0.0055 -0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3983 -0.6023 -1.8391 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3117 -1.2192 2.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3812 -1.7836 1.4671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5607 -2.5100 -0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3312 -2.4614 -0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4781 -0.6169 -0.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5217 3.0762 1.1029 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7583 2.1766 1.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3849 -0.0807 0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 13 2 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 17 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$