BC7DB4 -OEChem-04012113342D 40 41 0 0 0 0 0 0 0999 V2000 3.7891 1.4576 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.1302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5103 3.2176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.4086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.6302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 4.1312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 4.9402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9116 4.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.4576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2815 3.6296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8937 3.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8308 5.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9648 5.4418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8277 4.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9764 3.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5282 4.3005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8467 4.8523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.3202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.3202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 1.2660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -4.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 18 2 0 0 0 0 3 22 2 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 4 24 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 5 32 1 0 0 0 0 6 13 2 0 0 0 0 6 21 1 0 0 0 0 7 22 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 23 1 0 0 0 0 9 12 2 0 0 0 0 9 14 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 17 1 0 0 0 0 12 20 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 22 1 0 0 0 0 16 18 1 0 0 0 0 16 21 2 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$