COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.833   1.350  -0.515  1.00  0.00           O  
HETATM    2  C   UNL     1       0.596   1.686   0.626  1.00  0.00           C  
HETATM    3  C   UNL     1       0.704   3.136   1.023  1.00  0.00           C  
HETATM    4  C   UNL     1       1.169   4.058  -0.119  1.00  0.00           C  
HETATM    5  N   UNL     1       2.543   3.798   0.363  1.00  0.00           N  
HETATM    6  C   UNL     1       3.341   5.031   0.369  1.00  0.00           C  
HETATM    7  C   UNL     1       2.030   3.491   1.720  1.00  0.00           C  
HETATM    8  N   UNL     1       0.231   0.763   1.538  1.00  0.00           N  
HETATM    9  C   UNL     1       0.120  -0.645   1.151  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.924  -0.789   0.042  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.302  -0.409   0.586  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.346  -0.553  -0.523  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.724  -0.173   0.022  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.768  -0.317  -1.087  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.147   0.063  -0.543  1.00  0.00           C  
HETATM   16  O   UNL     1      -7.122   1.416  -0.084  1.00  0.00           O  
HETATM   17  C   UNL     1      -8.191  -0.080  -1.652  1.00  0.00           C  
HETATM   18  C   UNL     1      -9.569   0.299  -1.107  1.00  0.00           C  
HETATM   19  O   UNL     1      -7.484  -0.802   0.544  1.00  0.00           O  
HETATM   20  C   UNL     1       1.455  -1.135   0.651  1.00  0.00           C  
HETATM   21  C   UNL     1       1.859  -2.436   0.558  1.00  0.00           C  
HETATM   22  C   UNL     1       1.064  -3.620   0.929  1.00  0.00           C  
HETATM   23  N   UNL     1       1.587  -4.854   0.785  1.00  0.00           N  
HETATM   24  O   UNL     1      -0.063  -3.484   1.364  1.00  0.00           O  
HETATM   25  N   UNL     1       2.478  -0.369   0.205  1.00  0.00           N  
HETATM   26  C   UNL     1       3.496  -1.209  -0.151  1.00  0.00           C  
HETATM   27  N   UNL     1       3.115  -2.445   0.065  1.00  0.00           N  
HETATM   28  C   UNL     1       4.809  -0.793  -0.692  1.00  0.00           C  
HETATM   29  C   UNL     1       5.768  -1.752  -1.018  1.00  0.00           C  
HETATM   30  C   UNL     1       6.990  -1.358  -1.522  1.00  0.00           C  
HETATM   31  C   UNL     1       7.265  -0.014  -1.705  1.00  0.00           C  
HETATM   32  C   UNL     1       6.318   0.942  -1.384  1.00  0.00           C  
HETATM   33  C   UNL     1       5.090   0.560  -0.885  1.00  0.00           C  
HETATM   34  H   UNL     1      -0.179   3.500   1.548  1.00  0.00           H  
HETATM   35  H   UNL     1       0.970   3.659  -1.114  1.00  0.00           H  
HETATM   36  H   UNL     1       0.850   5.094  -0.005  1.00  0.00           H  
HETATM   37  H   UNL     1       4.188   4.913   1.045  1.00  0.00           H  
HETATM   38  H   UNL     1       3.705   5.233  -0.638  1.00  0.00           H  
HETATM   39  H   UNL     1       2.722   5.863   0.705  1.00  0.00           H  
HETATM   40  H   UNL     1       1.964   4.361   2.373  1.00  0.00           H  
HETATM   41  H   UNL     1       2.520   2.639   2.193  1.00  0.00           H  
HETATM   42  H   UNL     1       0.042   1.032   2.451  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.184  -1.236   2.015  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.666  -0.129  -0.787  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.943  -1.821  -0.308  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.559  -1.069   1.415  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.283   0.623   0.936  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.089   0.107  -1.352  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.365  -1.585  -0.872  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.982  -0.832   0.851  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.705   0.859   0.371  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.511   0.343  -1.916  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.787  -1.349  -1.437  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.899   2.060  -0.771  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.933   0.579  -2.481  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.210  -1.113  -2.001  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.550   1.332  -0.758  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.313   0.197  -1.898  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.827  -0.360  -0.278  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.520  -1.738   0.305  1.00  0.00           H  
HETATM   61  H   UNL     1       2.486  -4.963   0.438  1.00  0.00           H  
HETATM   62  H   UNL     1       1.064  -5.634   1.030  1.00  0.00           H  
HETATM   63  H   UNL     1       2.487   0.599   0.147  1.00  0.00           H  
HETATM   64  H   UNL     1       5.555  -2.801  -0.875  1.00  0.00           H  
HETATM   65  H   UNL     1       7.734  -2.099  -1.775  1.00  0.00           H  
HETATM   66  H   UNL     1       8.223   0.289  -2.100  1.00  0.00           H  
HETATM   67  H   UNL     1       6.539   1.989  -1.528  1.00  0.00           H  
HETATM   68  H   UNL     1       4.349   1.307  -0.639  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    8                                       
CONECT    3    7    2    4   34                                       
CONECT    4    5    3   35   36                                       
CONECT    5    6    7    4                                            
CONECT    6    5   37   38   39                                       
CONECT    7    5    3   40   41                                       
CONECT    8    2    9   42                                            
CONECT    9    8   10   20   43                                       
CONECT   10   11    9   44   45                                       
CONECT   11   10   12   46   47                                       
CONECT   12   13   11   48   49                                       
CONECT   13   12   14   50   51                                       
CONECT   14   13   15   52   53                                       
CONECT   15   19   16   14   17                                       
CONECT   16   15   54                                                 
CONECT   17   15   18   55   56                                       
CONECT   18   17   57   58   59                                       
CONECT   19   15   60                                                 
CONECT   20    9   21   21   25                                       
CONECT   21   22   20   20   27                                       
CONECT   22   24   24   23   21                                       
CONECT   23   22   61   62                                            
CONECT   24   22   22                                                 
CONECT   25   20   26   63                                            
CONECT   26   27   27   25   28                                       
CONECT   27   21   26   26                                            
CONECT   28   26   29   29   33                                       
CONECT   29   28   28   30   64                                       
CONECT   30   29   31   31   65                                       
CONECT   31   30   30   32   66                                       
CONECT   32   33   33   31   67                                       
CONECT   33   28   32   32   68                                       
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   25                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
