B0RUN3 -OEChem-04022106082D 35 37 0 0 0 0 0 0 0999 V2000 4.8479 2.5503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 0.4812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 1.7412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 0.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 1.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 1.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 -0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 0.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0554 2.1285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -2.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 1.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 2.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7496 2.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 2.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1216 -0.6259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -1.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3345 -0.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3432 0.2348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4657 2.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -2.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -2.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5472 1.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6696 3.4040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2103 2.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 12 2 0 0 0 0 7 13 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 16 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 14 28 1 0 0 0 0 15 19 2 0 0 0 0 15 29 1 0 0 0 0 16 20 2 0 0 0 0 16 30 1 0 0 0 0 17 20 1 0 0 0 0 17 31 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$