BOP74I -OEChem-04012116422D 51 54 0 0 0 0 0 0 0999 V2000 4.4487 -5.5647 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9698 6.5231 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.4353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -4.5647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 4.4353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.0647 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.4353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -7.0592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -5.6580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -7.2672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.4353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.4353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -4.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -4.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 4.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 5.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5878 6.5231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2788 7.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 7.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -6.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8347 0.5179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4362 -0.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -1.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -1.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -2.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 -2.7547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 1.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 1.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 3.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 3.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 4.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 -3.9821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -4.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1775 6.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6433 7.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9144 7.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 -7.4741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -6.3363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 31 1 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 24 2 0 0 0 0 5 26 2 0 0 0 0 6 14 1 0 0 0 0 6 24 1 0 0 0 0 6 39 1 0 0 0 0 7 19 1 0 0 0 0 7 26 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 50 1 0 0 0 0 9 31 2 0 0 0 0 9 32 1 0 0 0 0 10 32 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 15 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 35 1 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 15 36 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 32 51 1 0 0 0 0 M END $$$$