COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       2.042   5.287  -0.264  1.00  0.00           C  
HETATM    2  N   UNL     1       6.850  -0.845   0.004  1.00  0.00           N  
HETATM    3  O   UNL     1       2.105   3.877  -0.040  1.00  0.00           O  
HETATM    4  C   UNL     1       0.925   3.207   0.006  1.00  0.00           C  
HETATM    5  N   UNL     1      10.287  -1.753  -0.986  1.00  0.00           N  
HETATM    6  O   UNL     1       5.989  -1.776   1.828  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.269   3.894  -0.162  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.807  -0.162   0.349  1.00  0.00           N  
HETATM    9  O   UNL     1       8.713  -0.413  -1.791  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.470   3.219  -0.117  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.018  -0.866   0.388  1.00  0.00           N  
HETATM   12  O   UNL     1      -6.209  -0.820   0.831  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.492   1.837   0.100  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.296   1.140   0.269  1.00  0.00           C  
HETATM   15  C   UNL     1       0.915   1.823   0.217  1.00  0.00           C  
HETATM   16  C   UNL     1       2.190   1.088   0.390  1.00  0.00           C  
HETATM   17  C   UNL     1       2.352   0.218   1.469  1.00  0.00           C  
HETATM   18  C   UNL     1       3.536  -0.465   1.631  1.00  0.00           C  
HETATM   19  C   UNL     1       4.576  -0.286   0.715  1.00  0.00           C  
HETATM   20  C   UNL     1       4.412   0.585  -0.366  1.00  0.00           C  
HETATM   21  C   UNL     1       3.226   1.263  -0.529  1.00  0.00           C  
HETATM   22  C   UNL     1       5.847  -1.018   0.888  1.00  0.00           C  
HETATM   23  C   UNL     1       8.111  -1.571   0.175  1.00  0.00           C  
HETATM   24  C   UNL     1       9.058  -1.203  -0.938  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.778   1.119   0.149  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.049  -2.295   0.069  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.144  -3.065   1.053  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.464  -4.484   1.107  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.258  -5.185  -0.252  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.452  -4.900  -1.122  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.235  -3.682  -2.041  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.531  -2.513  -1.327  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.160  -0.220   0.722  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.090   1.265   0.955  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.448   1.929   0.815  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.847   2.058  -0.624  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.024   1.918  -1.612  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.572   1.590  -1.461  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.085   1.869  -0.034  1.00  0.00           C  
HETATM   40  H   UNL     1       3.052   5.698  -0.278  1.00  0.00           H  
HETATM   41  H   UNL     1       1.558   5.481  -1.221  1.00  0.00           H  
HETATM   42  H   UNL     1       1.469   5.757   0.535  1.00  0.00           H  
HETATM   43  H   UNL     1       6.736  -0.241  -0.746  1.00  0.00           H  
HETATM   44  H   UNL     1      10.897  -1.516  -1.703  1.00  0.00           H  
HETATM   45  H   UNL     1      10.563  -2.385  -0.304  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.257   4.960  -0.329  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.396   3.758  -0.248  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.309   0.073   0.437  1.00  0.00           H  
HETATM   49  H   UNL     1       1.548   0.080   2.177  1.00  0.00           H  
HETATM   50  H   UNL     1       3.662  -1.138   2.466  1.00  0.00           H  
HETATM   51  H   UNL     1       5.216   0.724  -1.074  1.00  0.00           H  
HETATM   52  H   UNL     1       3.098   1.933  -1.365  1.00  0.00           H  
HETATM   53  H   UNL     1       8.556  -1.304   1.134  1.00  0.00           H  
HETATM   54  H   UNL     1       7.919  -2.644   0.150  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.071  -2.666   0.146  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.106  -2.948   0.743  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.263  -2.639   2.049  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.826  -4.962   1.850  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.504  -4.600   1.410  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.357  -4.800  -0.729  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.164  -6.260  -0.099  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.655  -5.775  -1.739  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.316  -4.712  -0.485  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.629  -3.989  -2.894  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.203  -3.340  -2.405  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.684  -1.602  -1.906  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.462  -2.721  -1.278  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.716   1.443   1.964  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.193   1.332   1.340  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.407   2.922   1.264  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.880   2.280  -0.849  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.410   2.046  -2.612  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.418   0.535  -1.690  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.994   2.194  -2.161  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.952   2.936   0.145  1.00  0.00           H  
CONECT    1    3   40   41   42                                       
CONECT    2   22   23   43                                            
CONECT    3    1    4                                                 
CONECT    4    3    7    7   15                                       
CONECT    5   24   44   45                                            
CONECT    6   22   22                                                 
CONECT    7    4    4   10   46                                       
CONECT    8   11   25   25                                            
CONECT    9   24   24                                                 
CONECT   10    7   13   13   47                                       
CONECT   11    8   26   33                                            
CONECT   12   33   33                                                 
CONECT   13   10   10   14   25                                       
CONECT   14   13   15   15   48                                       
CONECT   15    4   14   14   16                                       
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   49                                       
CONECT   18   17   19   19   50                                       
CONECT   19   18   18   20   22                                       
CONECT   20   19   21   21   51                                       
CONECT   21   16   20   20   52                                       
CONECT   22    2    6    6   19                                       
CONECT   23    2   24   53   54                                       
CONECT   24    5    9    9   23                                       
CONECT   25    8    8   13   39                                       
CONECT   26   11   27   32   55                                       
CONECT   27   26   28   56   57                                       
CONECT   28   27   29   58   59                                       
CONECT   29   28   30   60   61                                       
CONECT   30   29   31   62   63                                       
CONECT   31   30   32   64   65                                       
CONECT   32   26   31   66   67                                       
CONECT   33   11   12   12   34                                       
CONECT   34   33   35   39   68                                       
CONECT   35   34   36   69   70                                       
CONECT   36   35   37   37   71                                       
CONECT   37   36   36   38   72                                       
CONECT   38   37   39   73   74                                       
CONECT   39   25   34   38   75                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    7                                                      
CONECT   47   10                                                      
CONECT   48   14                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   34                                                      
CONECT   69   35                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
CONECT   72   37                                                      
CONECT   73   38                                                      
CONECT   74   38                                                      
CONECT   75   39                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
