COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.087   0.199  -0.107  1.00  0.00           N  
HETATM    2  N   UNL     1      -0.996   1.672   0.218  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.300   1.160   0.646  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.411   2.013   0.031  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.751   1.413   0.371  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.392  -0.381   0.219  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.521  -1.730  -0.440  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.325  -4.108  -0.343  1.00  0.00           C  
HETATM    9  C   UNL     1       0.074   0.853   0.189  1.00  0.00           C  
HETATM   10  C   UNL     1       1.311   1.903  -1.687  1.00  0.00           C  
HETATM   11  C   UNL     1       2.575   2.962  -3.564  1.00  0.00           C  
HETATM   12  C   UNL     1       6.013  -0.004   0.166  1.00  0.00           C  
HETATM   13  C   UNL     1       6.879  -1.236   0.203  1.00  0.00           C  
HETATM   14  C   UNL     1       7.401  -1.749  -0.970  1.00  0.00           C  
HETATM   15  C   UNL     1       8.469  -3.497   0.269  1.00  0.00           C  
HETATM   16  C   UNL     1       7.157  -1.850   1.409  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.460   0.333   4.312  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.764  -4.151  -1.657  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.069  -2.968  -2.304  1.00  0.00           C  
HETATM   20  C   UNL     1       1.415   1.380  -0.253  1.00  0.00           C  
HETATM   21  C   UNL     1       2.636   2.551  -2.091  1.00  0.00           C  
HETATM   22  C   UNL     1       2.884   3.789  -1.226  1.00  0.00           C  
HETATM   23  C   UNL     1       3.713   0.597  -0.047  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.365   0.272   2.787  1.00  0.00           C  
HETATM   25  C   UNL     1       8.196  -2.880  -0.937  1.00  0.00           C  
HETATM   26  C   UNL     1       7.957  -2.977   1.443  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.395   1.221   2.172  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.203  -2.871   0.273  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.941  -1.809  -1.687  1.00  0.00           N  
HETATM   30  N   UNL     1       2.406   0.303  -0.197  1.00  0.00           N  
HETATM   31  O   UNL     1      -3.336   3.341   0.553  1.00  0.00           O  
HETATM   32  O   UNL     1      -5.527   2.024   1.076  1.00  0.00           O  
HETATM   33  O   UNL     1      -0.043  -0.308   0.517  1.00  0.00           O  
HETATM   34  O   UNL     1       4.069   1.755   0.041  1.00  0.00           O  
HETATM   35  O   UNL     1       4.624  -0.394   0.004  1.00  0.00           O  
HETATM   36  H   UNL     1      -4.466  -0.289  -0.670  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.903   2.601  -0.045  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.410   0.126   0.317  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.290   2.041  -1.052  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.480  -0.494   1.299  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.183   0.277  -0.143  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.083  -5.016   0.189  1.00  0.00           H  
HETATM   43  H   UNL     1       1.091   1.075  -2.360  1.00  0.00           H  
HETATM   44  H   UNL     1       0.512   2.642  -1.747  1.00  0.00           H  
HETATM   45  H   UNL     1       1.763   3.675  -3.709  1.00  0.00           H  
HETATM   46  H   UNL     1       3.519   3.424  -3.852  1.00  0.00           H  
HETATM   47  H   UNL     1       2.398   2.080  -4.180  1.00  0.00           H  
HETATM   48  H   UNL     1       6.129   0.550   1.098  1.00  0.00           H  
HETATM   49  H   UNL     1       6.313   0.627  -0.670  1.00  0.00           H  
HETATM   50  H   UNL     1       7.188  -1.267  -1.913  1.00  0.00           H  
HETATM   51  H   UNL     1       9.090  -4.380   0.295  1.00  0.00           H  
HETATM   52  H   UNL     1       6.750  -1.449   2.326  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.261   1.351   4.648  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.460   0.036   4.626  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.726  -0.343   4.750  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.871  -5.096  -2.167  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.416  -2.993  -3.326  1.00  0.00           H  
HETATM   58  H   UNL     1       1.722   2.191   0.408  1.00  0.00           H  
HETATM   59  H   UNL     1       3.448   1.839  -1.946  1.00  0.00           H  
HETATM   60  H   UNL     1       2.928   3.496  -0.177  1.00  0.00           H  
HETATM   61  H   UNL     1       3.828   4.250  -1.514  1.00  0.00           H  
HETATM   62  H   UNL     1       2.072   4.502  -1.371  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.364   0.569   2.473  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.563  -0.746   2.451  1.00  0.00           H  
HETATM   65  H   UNL     1       8.595  -3.286  -1.854  1.00  0.00           H  
HETATM   66  H   UNL     1       8.175  -3.457   2.386  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.197   2.239   2.508  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.396   0.924   2.486  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.863  -2.800   1.295  1.00  0.00           H  
HETATM   70  H   UNL     1       2.122  -0.622  -0.267  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.436   3.392   1.514  1.00  0.00           H  
CONECT    1    5    6   36                                            
CONECT    2    3    9   37                                            
CONECT    3    4   27    2   38                                       
CONECT    4    5    3   31   39                                       
CONECT    5   32   32    4    1                                       
CONECT    6    7    1   40   41                                       
CONECT    7   29    6   28   28                                       
CONECT    8   18   18   28   42                                       
CONECT    9   33   33    2   20                                       
CONECT   10   20   21   43   44                                       
CONECT   11   21   45   46   47                                       
CONECT   12   13   35   48   49                                       
CONECT   13   16   14   14   12                                       
CONECT   14   13   13   25   50                                       
CONECT   15   26   25   25   51                                       
CONECT   16   26   26   13   52                                       
CONECT   17   24   53   54   55                                       
CONECT   18   19    8    8   56                                       
CONECT   19   29   29   18   57                                       
CONECT   20    9   10   30   58                                       
CONECT   21   10   22   11   59                                       
CONECT   22   21   60   61   62                                       
CONECT   23   35   30   34   34                                       
CONECT   24   17   27   63   64                                       
CONECT   25   15   15   14   65                                       
CONECT   26   16   16   15   66                                       
CONECT   27    3   24   67   68                                       
CONECT   28    7    7    8   69                                       
CONECT   29   19   19    7                                            
CONECT   30   20   23   70                                            
CONECT   31    4   71                                                 
CONECT   32    5    5                                                 
CONECT   33    9    9                                                 
CONECT   34   23   23                                                 
CONECT   35   12   23                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
