D0JI3T AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.413 0.036 -0.582 1.00 0.00 C HETATM 2 C UNL 1 0.577 -0.492 -2.295 1.00 0.00 C HETATM 3 C UNL 1 -0.511 -1.394 -1.776 1.00 0.00 C HETATM 4 C UNL 1 -1.077 -0.008 -1.176 1.00 0.00 C HETATM 5 C UNL 1 0.304 -0.755 0.986 1.00 0.00 C HETATM 6 C UNL 1 -2.492 0.236 -0.692 1.00 0.00 C HETATM 7 C UNL 1 -1.342 -2.717 -1.910 1.00 0.00 C HETATM 8 C UNL 1 1.575 -0.947 -3.355 1.00 0.00 C HETATM 9 C UNL 1 -0.901 -0.750 1.750 1.00 0.00 C HETATM 10 C UNL 1 -1.057 -1.295 3.038 1.00 0.00 C HETATM 11 C UNL 1 -0.018 -1.992 3.608 1.00 0.00 C HETATM 12 C UNL 1 1.194 -2.013 2.930 1.00 0.00 C HETATM 13 C UNL 1 1.370 -1.251 1.746 1.00 0.00 C HETATM 14 O UNL 1 -3.280 -0.784 -0.341 1.00 0.00 O HETATM 15 O UNL 1 -2.979 1.375 -0.752 1.00 0.00 O HETATM 16 O UNL 1 2.567 -0.000 -3.620 1.00 0.00 O HETATM 17 C UNL 1 -1.456 -3.497 -0.708 1.00 0.00 C HETATM 18 C UNL 1 -2.145 -4.701 -0.608 1.00 0.00 C HETATM 19 C UNL 1 -2.828 -5.158 -1.719 1.00 0.00 C HETATM 20 C UNL 1 -2.747 -4.422 -2.906 1.00 0.00 C HETATM 21 C UNL 1 -1.950 -3.270 -3.031 1.00 0.00 C HETATM 22 O UNL 1 1.219 -1.776 -4.225 1.00 0.00 O HETATM 23 C UNL 1 3.159 -0.036 -4.920 1.00 0.00 C HETATM 24 C UNL 1 2.902 1.057 -5.943 1.00 0.00 C HETATM 25 C UNL 1 1.754 1.997 -5.764 1.00 0.00 C HETATM 26 O UNL 1 3.635 1.157 -6.933 1.00 0.00 O HETATM 27 H UNL 1 0.921 0.988 -0.421 1.00 0.00 H HETATM 28 H UNL 1 0.203 0.385 -2.883 1.00 0.00 H HETATM 29 H UNL 1 0.253 -1.966 -1.216 1.00 0.00 H HETATM 30 H UNL 1 -1.028 0.917 -1.790 1.00 0.00 H HETATM 31 H UNL 1 -1.776 -0.218 1.410 1.00 0.00 H HETATM 32 H UNL 1 -1.991 -1.145 3.581 1.00 0.00 H HETATM 33 H UNL 1 -0.123 -2.427 4.600 1.00 0.00 H HETATM 34 H UNL 1 2.028 -2.554 3.373 1.00 0.00 H HETATM 35 H UNL 1 2.371 -0.865 1.562 1.00 0.00 H HETATM 36 H UNL 1 -2.870 -1.669 -0.375 1.00 0.00 H HETATM 37 H UNL 1 -0.972 -3.139 0.202 1.00 0.00 H HETATM 38 H UNL 1 -2.153 -5.249 0.329 1.00 0.00 H HETATM 39 H UNL 1 -3.393 -6.077 -1.665 1.00 0.00 H HETATM 40 H UNL 1 -3.341 -4.754 -3.763 1.00 0.00 H HETATM 41 H UNL 1 -1.806 -2.825 -4.012 1.00 0.00 H HETATM 42 H UNL 1 2.979 -1.001 -5.420 1.00 0.00 H HETATM 43 H UNL 1 4.239 -0.002 -4.693 1.00 0.00 H HETATM 44 H UNL 1 1.208 1.842 -4.840 1.00 0.00 H HETATM 45 H UNL 1 1.055 1.918 -6.611 1.00 0.00 H HETATM 46 H UNL 1 2.180 3.035 -5.738 1.00 0.00 H CONECT 1 2 4 5 27 CONECT 2 1 3 8 28 CONECT 3 2 4 7 29 CONECT 4 3 1 6 30 CONECT 5 9 13 1 CONECT 6 4 14 15 CONECT 7 17 21 3 CONECT 8 16 22 2 CONECT 9 5 10 31 CONECT 10 9 11 32 CONECT 11 10 12 33 CONECT 12 11 13 34 CONECT 13 12 5 35 CONECT 14 6 36 CONECT 15 6 CONECT 16 8 23 CONECT 17 7 18 37 CONECT 18 17 19 38 CONECT 19 18 20 39 CONECT 20 19 21 40 CONECT 21 20 7 41 CONECT 22 8 CONECT 23 16 24 42 43 CONECT 24 23 25 26 CONECT 25 24 44 45 46 CONECT 26 24 CONECT 27 1 CONECT 28 2 CONECT 29 3 CONECT 30 4 CONECT 31 9 CONECT 32 10 CONECT 33 11 CONECT 34 12 CONECT 35 13 CONECT 36 14 CONECT 37 17 CONECT 38 18 CONECT 39 19 CONECT 40 20 CONECT 41 21 CONECT 42 23 CONECT 43 23 CONECT 44 25 CONECT 45 25 CONECT 46 25 MASTER 0 0 0 0 0 0 0 0 46 0 46 0 END M END $$$$