BB3NU9 -OEChem-04012117012D 29 32 0 0 0 0 0 0 0999 V2000 8.2018 -0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2018 -1.7745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -0.3765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 1.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 0.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0749 0.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 1.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6575 0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5236 -0.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3896 0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5236 -1.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2556 -0.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2556 -1.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3896 -1.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7855 -0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4086 2.3352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 2.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8082 2.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3935 1.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 0.5768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0138 1.4397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3896 0.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9866 -1.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3896 -2.5897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 -1.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 -0.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 15 1 0 0 0 0 2 17 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 8 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$