B87OTQ -OEChem-04022101582D 37 39 0 0 0 0 0 0 0999 V2000 6.3301 -1.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 -1.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9331 0.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9331 -1.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -1.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 -1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9441 -0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 0.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 23 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 16 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$