BVXE92 -OEChem-04022106082D 40 42 0 0 0 0 0 0 0999 V2000 8.4927 3.4776 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 2.8702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -2.4776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 0.8011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 2.0612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 1.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 2.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 1.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 1.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0554 2.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 1.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 3.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7496 2.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -3.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4438 3.1686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 0.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 2.5628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3432 0.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4657 2.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -2.2877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5472 1.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6696 3.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -3.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -4.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -3.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2522 2.5790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0334 2.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6354 3.7583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 24 1 0 0 0 0 2 10 2 0 0 0 0 3 11 2 0 0 0 0 4 15 1 0 0 0 0 4 23 1 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 5 25 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 14 18 2 0 0 0 0 14 28 1 0 0 0 0 15 19 2 0 0 0 0 16 20 1 0 0 0 0 16 29 1 0 0 0 0 17 21 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 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 22 1 0 0 0 0 21 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 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$