B8CJE0 -OEChem-04012117162D 29 31 0 0 0 0 0 0 0999 V2000 8.0901 2.0773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.0185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 -0.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 1.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2052 2.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 16 2 0 0 0 0 3 18 2 0 0 0 0 4 11 1 0 0 0 0 4 18 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 6 16 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 12 2 0 0 0 0 9 14 1 0 0 0 0 10 16 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 23 1 0 0 0 0 13 15 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$