COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.846   1.002  -0.109  1.00  0.00           C  
HETATM    2  C   UNL     1       2.438   0.741  -0.647  1.00  0.00           C  
HETATM    3  C   UNL     1       1.475   1.790  -0.087  1.00  0.00           C  
HETATM    4  C   UNL     1       0.067   1.528  -0.624  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.896   2.577  -0.064  1.00  0.00           C  
HETATM    6  C   UNL     1      13.517  -1.083   0.651  1.00  0.00           C  
HETATM    7  C   UNL     1      12.228  -1.560  -0.021  1.00  0.00           C  
HETATM    8  C   UNL     1      11.071  -0.647   0.390  1.00  0.00           C  
HETATM    9  C   UNL     1       9.782  -1.124  -0.282  1.00  0.00           C  
HETATM   10  C   UNL     1       8.625  -0.212   0.128  1.00  0.00           C  
HETATM   11  C   UNL     1       7.336  -0.689  -0.544  1.00  0.00           C  
HETATM   12  C   UNL     1       6.196   0.211  -0.140  1.00  0.00           C  
HETATM   13  C   UNL     1       4.809  -0.047  -0.669  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.283   2.320  -0.594  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.284   2.170   0.238  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.671   1.913  -0.292  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.229   0.635   0.338  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.584   0.305  -0.292  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.106  -1.013   0.283  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.413  -1.393  -0.416  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.084  -2.098   0.062  1.00  0.00           C  
HETATM   22  N   UNL     1      -7.349  -0.857   1.724  1.00  0.00           N  
HETATM   23  O   UNL     1       6.394   1.137   0.609  1.00  0.00           O  
HETATM   24  O   UNL     1      -8.158  -1.638  -1.801  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.290  -2.004  -0.844  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.056  -3.169   0.870  1.00  0.00           O  
HETATM   27  O   UNL     1      -7.511   1.352  -0.001  1.00  0.00           O  
HETATM   28  O   UNL     1      -5.391   0.828   1.744  1.00  0.00           O  
HETATM   29  H   UNL     1       4.173   1.996  -0.415  1.00  0.00           H  
HETATM   30  H   UNL     1       3.837   0.942   0.979  1.00  0.00           H  
HETATM   31  H   UNL     1       2.448   0.801  -1.735  1.00  0.00           H  
HETATM   32  H   UNL     1       2.111  -0.253  -0.341  1.00  0.00           H  
HETATM   33  H   UNL     1       1.466   1.729   1.002  1.00  0.00           H  
HETATM   34  H   UNL     1       1.802   2.783  -0.393  1.00  0.00           H  
HETATM   35  H   UNL     1       0.077   1.589  -1.713  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.260   0.535  -0.318  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.905   2.517   1.024  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.569   3.571  -0.370  1.00  0.00           H  
HETATM   39  H   UNL     1      13.733  -0.061   0.340  1.00  0.00           H  
HETATM   40  H   UNL     1      13.396  -1.115   1.734  1.00  0.00           H  
HETATM   41  H   UNL     1      14.342  -1.733   0.359  1.00  0.00           H  
HETATM   42  H   UNL     1      12.350  -1.528  -1.104  1.00  0.00           H  
HETATM   43  H   UNL     1      12.013  -2.582   0.291  1.00  0.00           H  
HETATM   44  H   UNL     1      10.950  -0.679   1.472  1.00  0.00           H  
HETATM   45  H   UNL     1      11.286   0.375   0.078  1.00  0.00           H  
HETATM   46  H   UNL     1       9.904  -1.092  -1.365  1.00  0.00           H  
HETATM   47  H   UNL     1       9.567  -2.146   0.029  1.00  0.00           H  
HETATM   48  H   UNL     1       8.503  -0.243   1.211  1.00  0.00           H  
HETATM   49  H   UNL     1       8.840   0.811  -0.184  1.00  0.00           H  
HETATM   50  H   UNL     1       7.457  -0.657  -1.627  1.00  0.00           H  
HETATM   51  H   UNL     1       7.121  -1.711  -0.233  1.00  0.00           H  
HETATM   52  H   UNL     1       4.482  -1.041  -0.363  1.00  0.00           H  
HETATM   53  H   UNL     1       4.819   0.013  -1.758  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.451   2.259  -1.659  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.115   2.231   1.303  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.318   2.753  -0.041  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.631   1.797  -1.375  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.536  -0.189   0.161  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.470   0.210  -1.372  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.823  -2.292   0.043  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.128  -0.576  -0.318  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.850  -1.650   2.094  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.485  -0.709   2.223  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.944  -1.885  -2.307  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.383  -3.839   0.689  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.735   1.431   0.937  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.995   1.546   1.975  1.00  0.00           H  
CONECT    1   13    2   29   30                                       
CONECT    2    1    3   31   32                                       
CONECT    3    2    4   33   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    4   14   37   38                                       
CONECT    6    7   39   40   41                                       
CONECT    7    6    8   42   43                                       
CONECT    8    7    9   44   45                                       
CONECT    9    8   10   46   47                                       
CONECT   10    9   11   48   49                                       
CONECT   11   10   12   50   51                                       
CONECT   12   11   23   23   13                                       
CONECT   13   12    1   52   53                                       
CONECT   14    5   15   15   54                                       
CONECT   15   14   14   16   55                                       
CONECT   16   15   17   56   57                                       
CONECT   17   16   28   18   58                                       
CONECT   18   17   27   19   59                                       
CONECT   19   18   21   20   22                                       
CONECT   20   19   24   60   61                                       
CONECT   21   25   25   26   19                                       
CONECT   22   19   62   63                                            
CONECT   23   12   12                                                 
CONECT   24   20   64                                                 
CONECT   25   21   21                                                 
CONECT   26   21   65                                                 
CONECT   27   18   66                                                 
CONECT   28   17   67                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   24                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
