BK5C0F -OEChem-04012119282D 49 51 0 1 0 0 0 0 0999 V2000 4.4487 0.4483 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0134 3.5901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 -0.4177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 1.3143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3037 1.2035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 -1.7689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5766 -0.5517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5713 -3.6699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.9483 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.9930 -1.3564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.9428 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5000 2.1507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 2.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.5517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3037 -2.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 0.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5766 -0.5517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2822 -2.5132 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7565 4.2592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5928 -3.4637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 1.7206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 2.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 2.4029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 0.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 0.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 1.6491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 0.8240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5498 2.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 2.8442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.0683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 -1.3617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6898 -2.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2831 -2.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0895 -1.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1714 3.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2173 4.6741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 4.7200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -3.5510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5723 -4.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5567 -1.8967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7639 -4.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 2 15 1 0 0 0 0 2 26 1 0 0 0 0 5 23 2 0 0 0 0 25 6 1 6 0 0 0 6 48 1 0 0 0 0 7 24 2 0 0 0 0 8 27 1 0 0 0 0 8 49 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 19 1 0 0 0 0 10 22 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 1 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 25 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END $$$$