D06XJG AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.331 -0.254 1.684 1.00 0.00 C HETATM 2 C UNL 1 1.101 -0.462 3.064 1.00 0.00 C HETATM 3 C UNL 1 -0.215 -0.625 3.567 1.00 0.00 C HETATM 4 C UNL 1 -1.293 -0.699 2.671 1.00 0.00 C HETATM 5 C UNL 1 -1.005 -0.668 1.291 1.00 0.00 C HETATM 6 C UNL 1 0.274 -0.437 0.803 1.00 0.00 C HETATM 7 O UNL 1 2.553 0.204 1.280 1.00 0.00 O HETATM 8 N UNL 1 2.211 -0.519 3.948 1.00 0.00 N HETATM 9 C UNL 1 -2.728 -0.634 2.999 1.00 0.00 C HETATM 10 N UNL 1 -3.548 -0.128 2.106 1.00 0.00 N HETATM 11 C UNL 1 -4.812 0.042 2.598 1.00 0.00 C HETATM 12 C UNL 1 -5.018 -0.498 3.856 1.00 0.00 C HETATM 13 S UNL 1 -3.499 -1.091 4.460 1.00 0.00 S HETATM 14 C UNL 1 -5.718 0.831 1.724 1.00 0.00 C HETATM 15 C UNL 1 -6.263 -0.526 4.595 1.00 0.00 C HETATM 16 O UNL 1 -6.170 -1.159 5.792 1.00 0.00 O HETATM 17 O UNL 1 -7.328 -0.062 4.211 1.00 0.00 O HETATM 18 C UNL 1 2.265 -0.274 5.298 1.00 0.00 C HETATM 19 N UNL 1 3.446 -0.614 5.759 1.00 0.00 N HETATM 20 N UNL 1 4.147 -1.071 4.675 1.00 0.00 N HETATM 21 N UNL 1 3.417 -0.998 3.572 1.00 0.00 N HETATM 22 C UNL 1 2.690 0.870 0.012 1.00 0.00 C HETATM 23 C UNL 1 1.976 2.226 -0.016 1.00 0.00 C HETATM 24 C UNL 1 4.186 1.093 -0.198 1.00 0.00 C HETATM 25 H UNL 1 -0.407 -0.706 4.637 1.00 0.00 H HETATM 26 H UNL 1 -1.816 -0.742 0.567 1.00 0.00 H HETATM 27 H UNL 1 0.389 -0.354 -0.273 1.00 0.00 H HETATM 28 H UNL 1 -6.775 0.645 1.904 1.00 0.00 H HETATM 29 H UNL 1 -5.507 0.611 0.671 1.00 0.00 H HETATM 30 H UNL 1 -5.507 1.895 1.884 1.00 0.00 H HETATM 31 H UNL 1 -5.275 -1.513 5.960 1.00 0.00 H HETATM 32 H UNL 1 1.463 0.170 5.863 1.00 0.00 H HETATM 33 H UNL 1 2.341 0.227 -0.804 1.00 0.00 H HETATM 34 H UNL 1 2.216 2.819 0.872 1.00 0.00 H HETATM 35 H UNL 1 0.888 2.109 -0.035 1.00 0.00 H HETATM 36 H UNL 1 2.252 2.800 -0.908 1.00 0.00 H HETATM 37 H UNL 1 4.620 1.654 0.636 1.00 0.00 H HETATM 38 H UNL 1 4.381 1.637 -1.128 1.00 0.00 H HETATM 39 H UNL 1 4.709 0.132 -0.243 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 8 CONECT 3 2 4 25 CONECT 4 3 5 9 CONECT 5 4 6 26 CONECT 6 5 1 27 CONECT 7 1 22 CONECT 8 2 18 21 CONECT 9 4 10 13 CONECT 10 9 11 CONECT 11 10 12 14 CONECT 12 11 13 15 CONECT 13 12 9 CONECT 14 11 28 29 30 CONECT 15 12 16 17 CONECT 16 15 31 CONECT 17 15 CONECT 18 8 19 32 CONECT 19 18 20 CONECT 20 19 21 CONECT 21 20 8 CONECT 22 7 23 24 33 CONECT 23 22 34 35 36 CONECT 24 22 37 38 39 CONECT 25 3 CONECT 26 5 CONECT 27 6 CONECT 28 14 CONECT 29 14 CONECT 30 14 CONECT 31 16 CONECT 32 18 CONECT 33 22 CONECT 34 23 CONECT 35 23 CONECT 36 23 CONECT 37 24 CONECT 38 24 CONECT 39 24 MASTER 0 0 0 0 0 0 0 0 39 0 39 0 END M END $$$$