B96SDF -OEChem-04022108422D 20 20 0 0 0 0 0 0 0999 V2000 2.8660 -2.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 2 10 2 0 0 0 0 3 10 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 M END $$$$