EXO0690 -OEChem-04222009333D 35 37 0 0 0 0 0 0 0999 V2000 -4.1498 -4.4347 -0.0030 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.6441 -0.1141 0.0005 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7115 -1.2826 -0.0003 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7498 4.9645 0.0001 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2182 -0.5662 1.2598 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2369 -0.5425 -1.2591 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1513 -1.5528 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.2071 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1439 -0.5933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9495 -0.5346 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9188 -1.0385 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9188 -1.0396 1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2725 -0.7023 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2726 -0.7033 1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0414 0.8504 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 -2.8735 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0718 -2.8710 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6577 1.6645 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9924 1.5411 -1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9926 1.5415 1.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8937 2.9325 -1.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 2.9329 1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8446 3.6285 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4057 -1.1637 -2.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4056 -1.1655 2.1584 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7786 -0.5694 -2.1598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7776 -0.5706 2.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0982 -3.7785 -0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1492 2.0231 0.8978 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6985 1.9955 0.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1567 2.0240 -0.8998 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0283 1.0136 -2.1574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0286 1.0141 2.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8546 3.4743 -2.1478 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 3.4750 2.1488 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 10 1 0 0 0 0 2 18 1 0 0 0 0 3 9 1 0 0 0 0 3 17 1 0 0 0 0 4 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 16 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 15 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$