L52SDT -OEChem-05022323042D 40 42 0 0 0 0 0 0 0999 V2000 2.0000 2.9400 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4400 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 5.3060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.5740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.2764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 1.1424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 -0.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 0.9345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 -1.0732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1079 1.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 10 1 0 0 0 0 3 21 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 9 23 2 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 27 3 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 24 1 0 0 0 0 17 32 1 0 0 0 0 18 25 2 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 24 26 2 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 M END $$$$