D0XH7H AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.683 1.177 0.880 1.00 0.00 C HETATM 2 C UNL 1 1.536 2.086 0.939 1.00 0.00 C HETATM 3 N UNL 1 1.202 2.940 -0.039 1.00 0.00 N HETATM 4 C UNL 1 2.108 2.980 -1.004 1.00 0.00 C HETATM 5 C UNL 1 3.219 2.162 -1.137 1.00 0.00 C HETATM 6 C UNL 1 3.557 1.138 -0.226 1.00 0.00 C HETATM 7 N UNL 1 2.238 4.045 -1.875 1.00 0.00 N HETATM 8 C UNL 1 3.666 4.192 -1.830 1.00 0.00 C HETATM 9 C UNL 1 4.073 2.868 -2.079 1.00 0.00 C HETATM 10 N UNL 1 4.574 0.134 0.089 1.00 0.00 N HETATM 11 C UNL 1 4.045 -0.333 1.331 1.00 0.00 C HETATM 12 N UNL 1 3.029 0.301 1.811 1.00 0.00 N HETATM 13 C UNL 1 5.748 -0.820 -0.462 1.00 0.00 C HETATM 14 C UNL 1 7.247 -1.011 0.133 1.00 0.00 C HETATM 15 C UNL 1 8.339 -2.070 -0.595 1.00 0.00 C HETATM 16 C UNL 1 8.420 -2.149 -2.161 1.00 0.00 C HETATM 17 C UNL 1 6.970 -2.301 -2.575 1.00 0.00 C HETATM 18 C UNL 1 5.925 -1.305 -1.913 1.00 0.00 C HETATM 19 C UNL 1 9.362 -3.299 -2.857 1.00 0.00 C HETATM 20 S UNL 1 9.193 -3.332 -4.708 1.00 0.00 S HETATM 21 N UNL 1 10.265 -4.438 -5.394 1.00 0.00 N HETATM 22 O UNL 1 7.930 -3.771 -5.082 1.00 0.00 O HETATM 23 O UNL 1 9.691 -1.999 -5.197 1.00 0.00 O HETATM 24 C UNL 1 11.715 -4.220 -5.422 1.00 0.00 C HETATM 25 H UNL 1 0.949 2.200 1.856 1.00 0.00 H HETATM 26 H UNL 1 1.611 4.792 -1.784 1.00 0.00 H HETATM 27 H UNL 1 3.915 4.829 -0.966 1.00 0.00 H HETATM 28 H UNL 1 4.030 2.569 -3.131 1.00 0.00 H HETATM 29 H UNL 1 4.394 -1.268 1.770 1.00 0.00 H HETATM 30 H UNL 1 5.282 -1.719 -0.033 1.00 0.00 H HETATM 31 H UNL 1 7.140 -1.400 1.154 1.00 0.00 H HETATM 32 H UNL 1 7.752 -0.046 0.210 1.00 0.00 H HETATM 33 H UNL 1 8.144 -3.085 -0.217 1.00 0.00 H HETATM 34 H UNL 1 9.344 -1.825 -0.222 1.00 0.00 H HETATM 35 H UNL 1 8.823 -1.199 -2.528 1.00 0.00 H HETATM 36 H UNL 1 6.688 -3.349 -2.383 1.00 0.00 H HETATM 37 H UNL 1 6.876 -2.190 -3.668 1.00 0.00 H HETATM 38 H UNL 1 6.357 -0.436 -2.420 1.00 0.00 H HETATM 39 H UNL 1 5.181 -2.115 -1.945 1.00 0.00 H HETATM 40 H UNL 1 9.104 -4.316 -2.542 1.00 0.00 H HETATM 41 H UNL 1 10.427 -3.114 -2.651 1.00 0.00 H HETATM 42 H UNL 1 9.899 -4.632 -6.331 1.00 0.00 H HETATM 43 H UNL 1 12.127 -4.347 -4.420 1.00 0.00 H HETATM 44 H UNL 1 11.985 -3.247 -5.837 1.00 0.00 H HETATM 45 H UNL 1 12.163 -4.980 -6.070 1.00 0.00 H CONECT 1 2 6 12 CONECT 2 1 3 25 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 9 CONECT 6 5 1 10 CONECT 7 4 8 26 CONECT 8 7 9 27 CONECT 9 8 5 28 CONECT 10 6 11 13 CONECT 11 10 12 29 CONECT 12 11 1 CONECT 13 14 18 10 30 CONECT 14 13 15 31 32 CONECT 15 14 16 33 34 CONECT 16 15 17 19 35 CONECT 17 16 18 36 37 CONECT 18 17 13 38 39 CONECT 19 16 20 40 41 CONECT 20 19 21 22 23 CONECT 21 20 24 42 CONECT 22 20 CONECT 23 20 CONECT 24 21 43 44 45 CONECT 25 2 CONECT 26 7 CONECT 27 8 CONECT 28 9 CONECT 29 11 CONECT 30 13 CONECT 31 14 CONECT 32 14 CONECT 33 15 CONECT 34 15 CONECT 35 16 CONECT 36 17 CONECT 37 17 CONECT 38 18 CONECT 39 18 CONECT 40 19 CONECT 41 19 CONECT 42 21 CONECT 43 24 CONECT 44 24 CONECT 45 24 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$