D0N6JZ AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.985 -1.981 0.465 1.00 0.00 C HETATM 2 C UNL 1 3.973 -2.920 0.894 1.00 0.00 C HETATM 3 C UNL 1 4.657 -2.660 2.084 1.00 0.00 C HETATM 4 C UNL 1 3.988 -1.799 2.981 1.00 0.00 C HETATM 5 C UNL 1 2.649 -1.377 2.718 1.00 0.00 C HETATM 6 C UNL 1 2.099 -1.600 1.457 1.00 0.00 C HETATM 7 N UNL 1 6.058 -3.145 2.235 1.00 0.00 N HETATM 8 S UNL 1 6.444 -4.666 3.049 1.00 0.00 S HETATM 9 CL UNL 1 0.404 -1.516 1.202 1.00 0.00 Cl HETATM 10 N UNL 1 3.513 -0.982 -0.477 1.00 0.00 N HETATM 11 C UNL 1 3.126 0.279 -0.903 1.00 0.00 C HETATM 12 C UNL 1 3.803 1.002 -1.827 1.00 0.00 C HETATM 13 C UNL 1 2.707 1.716 -2.546 1.00 0.00 C HETATM 14 C UNL 1 1.377 1.494 -1.925 1.00 0.00 C HETATM 15 C UNL 1 1.854 1.020 -0.566 1.00 0.00 C HETATM 16 O UNL 1 2.902 2.367 -3.595 1.00 0.00 O HETATM 17 C UNL 1 4.890 1.980 -1.434 1.00 0.00 C HETATM 18 O UNL 1 6.847 -4.264 4.375 1.00 0.00 O HETATM 19 O UNL 1 5.350 -5.602 2.828 1.00 0.00 O HETATM 20 C UNL 1 8.052 -5.453 2.267 1.00 0.00 C HETATM 21 C UNL 1 8.147 -6.896 2.191 1.00 0.00 C HETATM 22 C UNL 1 7.805 -7.543 0.986 1.00 0.00 C HETATM 23 C UNL 1 8.007 -6.785 -0.157 1.00 0.00 C HETATM 24 C UNL 1 7.941 -5.387 -0.079 1.00 0.00 C HETATM 25 C UNL 1 8.397 -4.780 1.100 1.00 0.00 C HETATM 26 C UNL 1 9.494 -7.605 2.628 1.00 0.00 C HETATM 27 H UNL 1 3.565 -3.953 0.943 1.00 0.00 H HETATM 28 H UNL 1 4.461 -1.445 3.889 1.00 0.00 H HETATM 29 H UNL 1 2.061 -0.849 3.469 1.00 0.00 H HETATM 30 H UNL 1 6.562 -2.449 2.797 1.00 0.00 H HETATM 31 H UNL 1 4.179 -1.430 -1.110 1.00 0.00 H HETATM 32 H UNL 1 0.844 0.707 -2.467 1.00 0.00 H HETATM 33 H UNL 1 0.803 2.414 -1.877 1.00 0.00 H HETATM 34 H UNL 1 1.064 0.492 -0.064 1.00 0.00 H HETATM 35 H UNL 1 2.111 1.890 0.061 1.00 0.00 H HETATM 36 H UNL 1 4.917 2.847 -2.106 1.00 0.00 H HETATM 37 H UNL 1 5.878 1.521 -1.435 1.00 0.00 H HETATM 38 H UNL 1 4.690 2.387 -0.431 1.00 0.00 H HETATM 39 H UNL 1 7.933 -8.629 0.904 1.00 0.00 H HETATM 40 H UNL 1 8.694 -7.229 -0.889 1.00 0.00 H HETATM 41 H UNL 1 6.870 -5.107 -0.228 1.00 0.00 H HETATM 42 H UNL 1 9.487 -4.591 1.047 1.00 0.00 H HETATM 43 H UNL 1 10.281 -6.891 2.880 1.00 0.00 H HETATM 44 H UNL 1 9.921 -8.179 1.778 1.00 0.00 H HETATM 45 H UNL 1 9.337 -8.337 3.424 1.00 0.00 H CONECT 1 2 6 10 CONECT 2 1 3 27 CONECT 3 2 4 7 CONECT 4 3 5 28 CONECT 5 4 6 29 CONECT 6 5 1 9 CONECT 7 3 8 30 CONECT 8 7 18 19 20 CONECT 9 6 CONECT 10 1 11 31 CONECT 11 10 12 15 CONECT 12 11 13 17 CONECT 13 12 14 16 CONECT 14 13 15 32 33 CONECT 15 14 11 34 35 CONECT 16 13 CONECT 17 12 36 37 38 CONECT 18 8 CONECT 19 8 CONECT 20 8 21 25 CONECT 21 20 22 26 CONECT 22 21 23 39 CONECT 23 22 24 40 CONECT 24 23 25 41 CONECT 25 24 20 42 CONECT 26 21 43 44 45 CONECT 27 2 CONECT 28 4 CONECT 29 5 CONECT 30 7 CONECT 31 10 CONECT 32 14 CONECT 33 14 CONECT 34 15 CONECT 35 15 CONECT 36 17 CONECT 37 17 CONECT 38 17 CONECT 39 22 CONECT 40 23 CONECT 41 24 CONECT 42 25 CONECT 43 26 CONECT 44 26 CONECT 45 26 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$