COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      10.972   2.343  -0.371  1.00  0.00           N  
HETATM    2  C   UNL     1       9.751   1.694  -0.317  1.00  0.00           C  
HETATM    3  N   UNL     1       9.394   0.911  -1.324  1.00  0.00           N  
HETATM    4  C   UNL     1       8.230   0.273  -1.308  1.00  0.00           C  
HETATM    5  N   UNL     1       7.861  -0.545  -2.362  1.00  0.00           N  
HETATM    6  N   UNL     1       8.975   1.871   0.743  1.00  0.00           N  
HETATM    7  C   UNL     1       7.800   1.270   0.836  1.00  0.00           C  
HETATM    8  C   UNL     1       6.929   1.481   2.047  1.00  0.00           C  
HETATM    9  C   UNL     1       7.178   0.358   3.056  1.00  0.00           C  
HETATM   10  C   UNL     1       7.378   0.441  -0.201  1.00  0.00           C  
HETATM   11  C   UNL     1       6.068  -0.251  -0.137  1.00  0.00           C  
HETATM   12  C   UNL     1       6.016  -1.637   0.001  1.00  0.00           C  
HETATM   13  C   UNL     1       4.796  -2.278   0.061  1.00  0.00           C  
HETATM   14  C   UNL     1       4.885   0.484  -0.209  1.00  0.00           C  
HETATM   15  C   UNL     1       3.668  -0.163  -0.149  1.00  0.00           C  
HETATM   16  C   UNL     1       3.620  -1.544  -0.017  1.00  0.00           C  
HETATM   17  O   UNL     1       2.420  -2.178   0.041  1.00  0.00           O  
HETATM   18  C   UNL     1       1.250  -1.362  -0.045  1.00  0.00           C  
HETATM   19  C   UNL     1       0.004  -2.246   0.038  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.248  -1.372  -0.054  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.412  -2.197   0.024  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.617  -1.573  -0.043  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.675  -0.193  -0.186  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.897   0.444  -0.254  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.787  -2.316   0.026  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.012  -1.686  -0.042  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.074  -0.300  -0.179  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.389   0.382  -0.252  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.227   0.439   0.859  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.811  -0.193   2.162  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.153   0.862   3.053  1.00  0.00           C  
HETATM   32  N   UNL     1      -9.393   1.056   0.755  1.00  0.00           N  
HETATM   33  C   UNL     1      -7.821   0.993  -1.444  1.00  0.00           C  
HETATM   34  N   UNL     1      -7.024   0.969  -2.575  1.00  0.00           N  
HETATM   35  N   UNL     1      -9.005   1.592  -1.465  1.00  0.00           N  
HETATM   36  C   UNL     1      -9.771   1.617  -0.385  1.00  0.00           C  
HETATM   37  N   UNL     1     -11.000   2.251  -0.446  1.00  0.00           N  
HETATM   38  H   UNL     1      11.249   2.916   0.361  1.00  0.00           H  
HETATM   39  H   UNL     1      11.553   2.220  -1.138  1.00  0.00           H  
HETATM   40  H   UNL     1       8.455  -0.655  -3.121  1.00  0.00           H  
HETATM   41  H   UNL     1       7.009  -1.008  -2.342  1.00  0.00           H  
HETATM   42  H   UNL     1       7.169   2.441   2.505  1.00  0.00           H  
HETATM   43  H   UNL     1       5.881   1.473   1.747  1.00  0.00           H  
HETATM   44  H   UNL     1       7.023  -0.606   2.573  1.00  0.00           H  
HETATM   45  H   UNL     1       8.203   0.420   3.423  1.00  0.00           H  
HETATM   46  H   UNL     1       6.486   0.461   3.893  1.00  0.00           H  
HETATM   47  H   UNL     1       6.930  -2.209   0.061  1.00  0.00           H  
HETATM   48  H   UNL     1       4.755  -3.352   0.167  1.00  0.00           H  
HETATM   49  H   UNL     1       4.922   1.558  -0.311  1.00  0.00           H  
HETATM   50  H   UNL     1       2.752   0.406  -0.204  1.00  0.00           H  
HETATM   51  H   UNL     1       1.244  -0.647   0.779  1.00  0.00           H  
HETATM   52  H   UNL     1       1.251  -0.823  -0.993  1.00  0.00           H  
HETATM   53  H   UNL     1       0.010  -2.960  -0.785  1.00  0.00           H  
HETATM   54  H   UNL     1       0.003  -2.784   0.986  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.254  -0.658   0.770  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.247  -0.834  -1.001  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.763   0.382  -0.244  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.942   1.517  -0.365  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.739  -3.390   0.133  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.922  -2.265   0.012  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.689  -0.598   2.666  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.101  -0.997   1.966  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.328   1.330   2.515  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.888   1.621   3.322  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.773   0.388   3.958  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.160   0.529  -2.551  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.330   1.393  -3.393  1.00  0.00           H  
HETATM   68  H   UNL     1     -11.289   2.669  -1.272  1.00  0.00           H  
HETATM   69  H   UNL     1     -11.572   2.277   0.337  1.00  0.00           H  
CONECT    1    2   38   39                                            
CONECT    2    1    6    6    3                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3   10    5                                       
CONECT    5    4   40   41                                            
CONECT    6    2    2    7                                            
CONECT    7    6    8   10   10                                       
CONECT    8    9    7   42   43                                       
CONECT    9    8   44   45   46                                       
CONECT   10    7    7    4   11                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   47                                       
CONECT   13   12   16   16   48                                       
CONECT   14   11   15   15   49                                       
CONECT   15   14   14   16   50                                       
CONECT   16   13   13   15   17                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   51   52                                       
CONECT   19   20   18   53   54                                       
CONECT   20   21   19   55   56                                       
CONECT   21   22   20                                                 
CONECT   22   23   21   25   25                                       
CONECT   23   24   24   22   57                                       
CONECT   24   23   23   27   58                                       
CONECT   25   22   22   26   59                                       
CONECT   26   27   27   25   60                                       
CONECT   27   24   28   26   26                                       
CONECT   28   33   33   29   27                                       
CONECT   29   32   32   28   30                                       
CONECT   30   31   29   61   62                                       
CONECT   31   30   63   64   65                                       
CONECT   32   36   29   29                                            
CONECT   33   35   34   28   28                                       
CONECT   34   33   66   67                                            
CONECT   35   36   36   33                                            
CONECT   36   37   35   35   32                                       
CONECT   37   36   68   69                                            
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
