BGF3V2 -OEChem-04012113032D 38 40 0 0 0 0 0 0 0999 V2000 9.4372 1.0574 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.8187 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 2.1277 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9478 3.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6672 2.7698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0491 0.8676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3092 1.5097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8614 3.5801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 2.1277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 2.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 3.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0305 1.9709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5305 2.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4381 0.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 3.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 3.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5898 2.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1416 3.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4602 3.5581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.7701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 17 1 0 0 0 0 4 11 1 0 0 0 0 4 15 1 0 0 0 0 7 16 2 0 0 0 0 8 24 1 0 0 0 0 8 38 1 0 0 0 0 9 15 1 0 0 0 0 9 27 1 0 0 0 0 10 16 1 0 0 0 0 10 19 1 0 0 0 0 10 30 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 28 1 0 0 0 0 15 18 2 0 0 0 0 17 29 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 1 0 0 0 0 21 31 1 0 0 0 0 22 25 2 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 26 37 1 0 0 0 0 M END $$$$