BOF7J3 -OEChem-04022117333D 45 49 0 0 0 0 0 0 0999 V2000 4.0949 -1.0198 -2.1057 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5193 0.0093 -0.6622 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3215 1.1431 -1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6195 1.9634 -0.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0851 2.6183 0.4226 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5482 3.0243 2.1972 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1709 0.7269 -1.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6084 -1.0570 -0.4386 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5622 1.2757 -0.1322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0691 -2.2318 1.0341 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9733 -1.1837 0.7973 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1946 -3.1647 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3489 -1.9742 -1.4525 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4918 1.8771 0.6687 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4535 -3.0218 -1.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6678 -0.0842 -1.4438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5789 -2.3749 2.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0986 -4.2129 0.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 1.9618 0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7638 2.3655 1.9419 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7746 2.5391 0.9557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4742 -3.4224 2.4897 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7336 -4.3398 1.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7184 2.9246 2.6591 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7884 1.8120 -0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0858 2.1876 -0.7953 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7951 1.3991 -1.6945 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8916 -0.0154 -1.8753 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1938 0.2748 -2.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2061 -0.5132 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8025 -1.8871 -2.4353 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2602 -3.7232 -2.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3924 -1.6691 3.0787 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3166 -4.9414 -0.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 1.6317 -0.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 1.4431 -1.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7582 2.3131 2.3722 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9691 -3.5214 3.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4308 -5.1550 1.6461 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 3.3189 3.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6958 3.1384 1.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5501 3.0669 -0.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8144 1.6602 -1.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3771 -0.8814 -2.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7275 -0.3545 -2.9522 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 36 1 0 0 0 0 4 9 2 0 0 0 0 5 21 1 0 0 0 0 5 25 1 0 0 0 0 5 41 1 0 0 0 0 6 21 2 0 0 0 0 6 24 1 0 0 0 0 7 25 1 0 0 0 0 7 28 2 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 30 1 0 0 0 0 12 15 1 0 0 0 0 12 18 2 0 0 0 0 13 15 2 0 0 0 0 13 31 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 32 1 0 0 0 0 17 22 1 0 0 0 0 17 33 1 0 0 0 0 18 23 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 24 2 0 0 0 0 20 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 29 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M END $$$$