BXAT90 -OEChem-04022106282D 35 35 0 1 0 0 0 0 0999 V2000 2.5369 0.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.4050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.0950 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4030 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 3.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 12 2 0 0 0 0 3 13 1 0 0 0 0 3 35 1 0 0 0 0 7 4 1 6 0 0 0 4 11 1 0 0 0 0 4 22 1 0 0 0 0 10 5 1 1 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 12 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 15 17 2 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 34 1 0 0 0 0 M END $$$$