D0FF3D -OEChem-10101305022D 27 28 0 0 0 0 0 0 0999 V2000 3.7601 -2.7702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 1.5086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 1.2298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 2.7686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 1.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 2.7686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 3.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6245 3.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 2.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 1.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 0.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -2.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -3.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -3.8072 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 7 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 17 1 0 0 0 0 5 8 2 0 0 0 0 5 11 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 8 16 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 14 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$