D0JU8E AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.512 0.778 0.939 1.00 0.00 C HETATM 2 C UNL 1 0.208 0.594 2.294 1.00 0.00 C HETATM 3 C UNL 1 -1.020 1.087 2.815 1.00 0.00 C HETATM 4 C UNL 1 -2.037 1.422 1.918 1.00 0.00 C HETATM 5 C UNL 1 -1.842 1.083 0.566 1.00 0.00 C HETATM 6 C UNL 1 -0.556 0.819 0.031 1.00 0.00 C HETATM 7 N UNL 1 1.921 0.735 0.898 1.00 0.00 N HETATM 8 C UNL 1 2.223 -0.305 1.770 1.00 0.00 C HETATM 9 C UNL 1 1.197 -0.350 2.696 1.00 0.00 C HETATM 10 O UNL 1 -3.319 1.860 2.244 1.00 0.00 O HETATM 11 C UNL 1 -3.539 2.923 3.135 1.00 0.00 C HETATM 12 N UNL 1 -2.877 2.972 4.302 1.00 0.00 N HETATM 13 C UNL 1 -3.284 3.925 5.157 1.00 0.00 C HETATM 14 N UNL 1 -4.277 4.822 4.971 1.00 0.00 N HETATM 15 C UNL 1 -4.941 4.747 3.799 1.00 0.00 C HETATM 16 C UNL 1 -4.605 3.789 2.843 1.00 0.00 C HETATM 17 C UNL 1 -6.128 5.700 3.637 1.00 0.00 C HETATM 18 N UNL 1 -5.827 7.135 3.798 1.00 0.00 N HETATM 19 C UNL 1 2.858 1.516 0.147 1.00 0.00 C HETATM 20 N UNL 1 4.057 1.809 0.868 1.00 0.00 N HETATM 21 O UNL 1 2.540 1.906 -0.978 1.00 0.00 O HETATM 22 C UNL 1 5.014 2.666 0.155 1.00 0.00 C HETATM 23 C UNL 1 7.736 5.104 -1.872 1.00 0.00 C HETATM 24 C UNL 1 6.798 4.263 -1.173 1.00 0.00 C HETATM 25 N UNL 1 6.055 4.723 -0.038 1.00 0.00 N HETATM 26 N UNL 1 5.221 3.851 0.839 1.00 0.00 N HETATM 27 C UNL 1 6.303 6.021 0.584 1.00 0.00 C HETATM 28 C UNL 1 -5.013 7.673 2.720 1.00 0.00 C HETATM 29 C UNL 1 7.423 2.843 -1.016 1.00 0.00 C HETATM 30 F UNL 1 8.695 2.804 -1.522 1.00 0.00 F HETATM 31 F UNL 1 7.590 2.488 0.291 1.00 0.00 F HETATM 32 F UNL 1 6.740 1.861 -1.643 1.00 0.00 F HETATM 33 H UNL 1 -1.191 1.104 3.887 1.00 0.00 H HETATM 34 H UNL 1 -2.713 1.009 -0.085 1.00 0.00 H HETATM 35 H UNL 1 -0.430 0.541 -1.010 1.00 0.00 H HETATM 36 H UNL 1 3.106 -0.909 1.617 1.00 0.00 H HETATM 37 H UNL 1 1.100 -1.074 3.496 1.00 0.00 H HETATM 38 H UNL 1 -2.795 3.969 6.125 1.00 0.00 H HETATM 39 H UNL 1 -5.159 3.697 1.919 1.00 0.00 H HETATM 40 H UNL 1 -6.848 5.454 4.430 1.00 0.00 H HETATM 41 H UNL 1 -6.660 5.534 2.694 1.00 0.00 H HETATM 42 H UNL 1 -5.340 7.258 4.688 1.00 0.00 H HETATM 43 H UNL 1 3.939 2.050 1.844 1.00 0.00 H HETATM 44 H UNL 1 8.409 5.706 -2.373 1.00 0.00 H HETATM 45 H UNL 1 7.234 6.456 0.216 1.00 0.00 H HETATM 46 H UNL 1 6.406 5.860 1.662 1.00 0.00 H HETATM 47 H UNL 1 5.453 6.671 0.372 1.00 0.00 H HETATM 48 H UNL 1 -5.506 7.548 1.750 1.00 0.00 H HETATM 49 H UNL 1 -4.024 7.208 2.687 1.00 0.00 H HETATM 50 H UNL 1 -4.868 8.748 2.872 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 9 CONECT 3 2 4 33 CONECT 4 3 5 10 CONECT 5 4 6 34 CONECT 6 5 1 35 CONECT 7 1 8 19 CONECT 8 7 9 36 CONECT 9 8 2 37 CONECT 10 4 11 CONECT 11 10 12 16 CONECT 12 11 13 CONECT 13 12 14 38 CONECT 14 13 15 CONECT 15 14 16 17 CONECT 16 15 11 39 CONECT 17 15 18 40 41 CONECT 18 17 28 42 CONECT 19 7 20 21 CONECT 20 19 22 43 CONECT 21 19 CONECT 22 20 23 26 CONECT 23 22 24 44 CONECT 24 29 23 25 CONECT 25 24 26 27 CONECT 26 25 22 CONECT 27 25 45 46 47 CONECT 28 18 48 49 50 CONECT 29 30 31 32 24 CONECT 30 29 CONECT 31 29 CONECT 32 29 CONECT 33 3 CONECT 34 5 CONECT 35 6 CONECT 36 8 CONECT 37 9 CONECT 38 13 CONECT 39 16 CONECT 40 17 CONECT 41 17 CONECT 42 18 CONECT 43 20 CONECT 44 23 CONECT 45 27 CONECT 46 27 CONECT 47 27 CONECT 48 28 CONECT 49 28 CONECT 50 28 MASTER 0 0 0 0 0 0 0 0 50 0 50 0 END M END $$$$