D07WQA -OEChem-04152108352D 27 28 0 0 0 0 0 0 0999 V2000 4.5981 -1.4441 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5559 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.5800 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4441 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5981 -1.4441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.4441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0559 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3660 2.4219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.6899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 2.0834 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.6315 0.7159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6249 2.4441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 1.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -0.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 2.2105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 -1.0987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 -0.2770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 7 1 0 0 0 0 2 8 2 0 0 0 0 2 9 2 0 0 0 0 2 16 1 0 0 0 0 3 10 1 0 0 0 0 3 11 2 0 0 0 0 3 12 2 0 0 0 0 3 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 13 20 1 0 0 0 0 14 17 2 0 0 0 0 14 19 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 19 21 2 0 0 0 0 19 25 1 0 0 0 0 20 22 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 22 27 1 0 0 0 0 M CHG 3 4 -1 7 -1 10 -1 M END $$$$