B3QG6P -OEChem-04012113192D 21 21 0 0 0 0 0 0 0999 V2000 2.8660 0.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 1.5950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5950 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 0.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 0.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 1.0581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 20 1 0 0 0 0 5 21 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 9 11 2 0 0 0 0 9 16 1 0 0 0 0 10 12 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 M END $$$$