BUT8B7 -OEChem-04042106223D 48 51 0 1 0 0 0 0 0999 V2000 3.8865 0.6529 2.7065 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5895 2.6829 -0.1736 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0984 -2.4070 -1.1216 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5469 -1.2513 0.3137 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7346 -0.5681 -0.4075 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4502 -1.3030 0.8545 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8692 -3.5268 0.3934 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 1.0165 -0.2939 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3321 0.7380 -0.4488 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0238 -0.1195 -0.6876 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9441 -1.3318 -1.5562 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1751 -1.0966 -0.7247 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -0.0238 0.4799 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7971 0.5172 1.7154 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9908 0.9511 0.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4738 -2.3392 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6605 0.5328 0.0805 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3139 2.2717 -0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6535 1.4349 -0.2621 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3068 3.1741 -0.5426 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9767 2.7558 -0.5736 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1874 -0.2583 -0.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6654 -0.3875 -0.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2773 -1.6039 0.1489 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6626 -1.6697 0.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6773 0.6356 -0.5371 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3834 -0.5329 -0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4455 0.6370 -0.1152 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7936 0.3331 0.3656 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9000 0.0859 0.7604 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2465 0.8204 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0368 -1.1849 -2.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0782 -0.7907 -1.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -1.7294 0.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3012 1.4766 1.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5538 -0.1932 2.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4252 -0.4874 0.3245 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3574 -3.6502 1.2602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9139 -4.3180 -0.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 4.2022 -0.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2022 3.4696 -0.8424 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3533 1.7333 -0.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7177 -2.4923 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1748 -2.6078 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1577 1.5606 -0.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5054 1.2410 -1.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9382 1.2191 0.6651 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8815 -0.1336 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 18 1 0 0 0 0 3 11 1 0 0 0 0 3 16 1 0 0 0 0 4 22 2 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 13 1 0 0 0 0 6 16 2 0 0 0 0 7 16 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 19 1 0 0 0 0 8 22 1 0 0 0 0 8 42 1 0 0 0 0 9 23 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 17 19 2 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 27 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 3 0 0 0 0 30 48 1 0 0 0 0 M END $$$$