BU48IR -OEChem-04012116422D 36 38 0 0 0 0 0 0 0999 V2000 2.0000 6.2650 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.1254 0.3928 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4042 -1.3672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 3.0290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4812 -4.9550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2132 -5.9550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9499 2.0109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0223 -1.3672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7132 -0.4162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2132 -2.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3472 -3.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2132 -1.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0793 -3.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3472 -4.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2132 -4.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0793 -4.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 -0.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 3.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5322 1.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 3.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 4.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9444 2.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 4.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 5.5605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 5.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8103 -3.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6162 -3.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6162 -4.7650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0462 0.9597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9629 1.7524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 3.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 4.8163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 4.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 6.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9442 -4.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7502 -6.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 17 1 0 0 0 0 2 19 1 0 0 0 0 3 12 1 0 0 0 0 3 17 1 0 0 0 0 4 18 1 0 0 0 0 4 22 1 0 0 0 0 5 14 1 0 0 0 0 5 35 1 0 0 0 0 6 15 1 0 0 0 0 6 36 1 0 0 0 0 7 22 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 17 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 0 0 0 0 13 16 2 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 23 1 0 0 0 0 20 31 1 0 0 0 0 21 24 2 0 0 0 0 21 32 1 0 0 0 0 23 25 2 0 0 0 0 23 33 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 M END $$$$