B78OAS -OEChem-04012114172D 56 60 0 0 0 0 0 0 0999 V2000 2.0000 -3.5046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.3318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.6682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.1682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.3706 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -3.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -2.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -4.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 -1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 -4.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -3.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 4.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -2.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 0.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 -1.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 -1.1768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 -1.9122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8064 -5.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -5.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 -4.3711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 1.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 1.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 3.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 3.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -0.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1079 -2.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 -1.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -3.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 -2.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0888 4.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 5.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4688 5.3688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 29 1 0 0 0 0 2 33 1 0 0 0 0 3 9 1 0 0 0 0 3 19 2 0 0 0 0 4 14 2 0 0 0 0 4 19 1 0 0 0 0 5 16 2 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 15 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 17 2 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 11 13 2 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 17 38 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 27 2 0 0 0 0 20 28 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 46 1 0 0 0 0 25 29 2 0 0 0 0 25 47 1 0 0 0 0 26 29 1 0 0 0 0 26 48 1 0 0 0 0 27 30 1 0 0 0 0 27 49 1 0 0 0 0 28 31 2 0 0 0 0 28 50 1 0 0 0 0 30 32 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M END $$$$