B8UW6O -OEChem-04022105452D 37 39 0 0 0 0 0 0 0999 V2000 8.7142 0.4770 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.1439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9601 1.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.6439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7857 0.2101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.6439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 0.3769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 0.8908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 -1.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 0.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.8561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.6439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8998 1.8752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3805 1.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8772 2.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3754 1.1220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9550 1.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5396 2.6439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 1.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 -1.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -0.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4375 2.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1271 2.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.4539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7864 1.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5133 1.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0426 2.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9021 3.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0366 3.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 15 1 0 0 0 0 2 32 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 20 2 0 0 0 0 5 21 2 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 24 1 0 0 0 0 10 13 2 0 0 0 0 10 25 1 0 0 0 0 11 15 2 0 0 0 0 11 20 1 0 0 0 0 12 17 2 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$