BH3J8Q -OEChem-04012117432D 36 38 0 0 0 0 0 0 0999 V2000 2.3660 1.2884 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4538 3.6362 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6937 3.3575 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7505 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 0.3373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2505 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4218 4.3356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9570 2.6883 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9538 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6448 3.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2628 3.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 0.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2139 3.3575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4858 4.3356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3182 1.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4674 0.1457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0923 4.4645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3569 4.9421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8794 4.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0114 4.5272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 4.7505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 2.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 17 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 15 1 0 0 0 0 3 24 1 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 20 1 0 0 0 0 8 23 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 23 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 16 2 0 0 0 0 14 25 1 0 0 0 0 16 23 1 0 0 0 0 17 26 1 0 0 0 0 18 21 1 0 0 0 0 18 27 1 0 0 0 0 19 22 2 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 24 31 1 0 0 0 0 24 32 1 0 0 0 0 24 33 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$