BB4VQ6 -OEChem-04012118552D 31 33 0 0 0 0 0 0 0999 V2000 2.3660 0.7342 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8258 4.2168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5526 2.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.2168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 1.5432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6349 4.8046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5471 2.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 3.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1349 3.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4439 4.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4674 -0.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -4.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5704 1.4784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4993 2.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0335 4.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 6 1 0 0 0 0 2 18 1 0 0 0 0 3 17 2 0 0 0 0 4 8 1 0 0 0 0 4 14 2 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 5 29 1 0 0 0 0 6 20 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 15 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 M END $$$$