B3BO1Q -OEChem-04012116562D 37 40 0 0 0 0 0 0 0999 V2000 4.6660 1.4409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.5591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4783 0.2456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4783 -1.3638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7889 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7674 1.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0619 -0.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4353 0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.4756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0781 2.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.5938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4138 0.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1246 -0.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0566 2.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7245 1.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7684 1.8158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1751 1.2835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6819 -0.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6640 2.8144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.2137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8279 0.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5353 -0.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 -0.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 -0.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2492 3.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3311 1.9427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 12 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 4 7 1 0 0 0 0 4 13 2 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 12 1 0 0 0 0 8 14 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 13 26 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 27 1 0 0 0 0 16 22 1 0 0 0 0 16 28 1 0 0 0 0 17 21 1 0 0 0 0 17 29 1 0 0 0 0 18 23 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$