COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.611  -0.518  -0.324  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.010   2.210   0.475  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.670   2.981   2.303  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.988   2.487   2.643  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.790   2.630   0.972  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.804  -1.401   0.267  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.141   1.828  -0.977  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.723   0.368  -1.159  1.00  0.00           C  
HETATM    9  C   UNL     1       0.600   0.554  -1.818  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.769   2.912   3.138  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.761  -2.040  -1.172  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.825  -0.868  -0.920  1.00  0.00           C  
HETATM   13  C   UNL     1       4.176  -1.339   2.952  1.00  0.00           C  
HETATM   14  C   UNL     1       4.534  -2.248   1.775  1.00  0.00           C  
HETATM   15  C   UNL     1       5.865  -1.798   1.168  1.00  0.00           C  
HETATM   16  C   UNL     1       4.660  -3.692   2.265  1.00  0.00           C  
HETATM   17  C   UNL     1       3.252  -0.958   0.229  1.00  0.00           C  
HETATM   18  C   UNL     1       2.037   0.502  -1.297  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.108   2.136   1.312  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.236  -1.235  -0.174  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.082  -1.848  -1.548  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.042  -0.278   0.414  1.00  0.00           C  
HETATM   23  C   UNL     1       3.008   0.747  -2.454  1.00  0.00           C  
HETATM   24  C   UNL     1       4.416   0.818  -1.923  1.00  0.00           C  
HETATM   25  C   UNL     1       4.943   2.032  -1.522  1.00  0.00           C  
HETATM   26  C   UNL     1       6.235   2.097  -1.034  1.00  0.00           C  
HETATM   27  C   UNL     1       6.999   0.949  -0.946  1.00  0.00           C  
HETATM   28  C   UNL     1       6.472  -0.265  -1.346  1.00  0.00           C  
HETATM   29  C   UNL     1       5.179  -0.331  -1.830  1.00  0.00           C  
HETATM   30  N   UNL     1       2.298  -0.815  -0.712  1.00  0.00           N  
HETATM   31  N   UNL     1      -0.327   0.201  -0.734  1.00  0.00           N  
HETATM   32  N   UNL     1      -3.941  -0.535  -0.541  1.00  0.00           N  
HETATM   33  N   UNL     1      -8.296  -0.127   0.034  1.00  0.00           N  
HETATM   34  O   UNL     1       3.491  -2.169   0.767  1.00  0.00           O  
HETATM   35  O   UNL     1       3.897   0.006   0.591  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.129  -1.218   0.541  1.00  0.00           O  
HETATM   37  H   UNL     1       0.283   3.309   2.691  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.845   2.429   3.297  1.00  0.00           H  
HETATM   39  H   UNL     1       0.069   2.684   0.319  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.713  -1.126   1.317  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.502  -2.440   0.136  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.177   1.951  -1.293  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.499   2.468  -1.581  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.818   0.091  -2.209  1.00  0.00           H  
HETATM   45  H   UNL     1       0.378   1.561  -2.172  1.00  0.00           H  
HETATM   46  H   UNL     1       0.485  -0.154  -2.638  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.675   3.187   4.179  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.155  -2.795  -1.649  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.855  -0.712  -1.207  1.00  0.00           H  
HETATM   50  H   UNL     1       3.228  -1.660   3.384  1.00  0.00           H  
HETATM   51  H   UNL     1       4.959  -1.398   3.708  1.00  0.00           H  
HETATM   52  H   UNL     1       4.086  -0.310   2.602  1.00  0.00           H  
HETATM   53  H   UNL     1       5.775  -0.769   0.818  1.00  0.00           H  
HETATM   54  H   UNL     1       6.647  -1.857   1.924  1.00  0.00           H  
HETATM   55  H   UNL     1       6.120  -2.446   0.330  1.00  0.00           H  
HETATM   56  H   UNL     1       4.915  -4.340   1.427  1.00  0.00           H  
HETATM   57  H   UNL     1       5.443  -3.751   3.022  1.00  0.00           H  
HETATM   58  H   UNL     1       3.712  -4.013   2.697  1.00  0.00           H  
HETATM   59  H   UNL     1       2.177   1.271  -0.538  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.060   1.804   0.925  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.524  -2.457  -2.323  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.641   0.354   1.193  1.00  0.00           H  
HETATM   63  H   UNL     1       2.931  -0.070  -3.172  1.00  0.00           H  
HETATM   64  H   UNL     1       2.757   1.687  -2.946  1.00  0.00           H  
HETATM   65  H   UNL     1       4.346   2.929  -1.590  1.00  0.00           H  
HETATM   66  H   UNL     1       6.647   3.045  -0.721  1.00  0.00           H  
HETATM   67  H   UNL     1       8.009   1.000  -0.566  1.00  0.00           H  
HETATM   68  H   UNL     1       7.070  -1.162  -1.278  1.00  0.00           H  
HETATM   69  H   UNL     1       4.766  -1.280  -2.139  1.00  0.00           H  
HETATM   70  H   UNL     1       1.783  -1.585  -1.001  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.158  -0.737  -0.405  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.327   0.025  -1.233  1.00  0.00           H  
CONECT    1   32    8   36   36                                       
CONECT    2   19    7    5    5                                       
CONECT    3   10   10    5   37                                       
CONECT    4   19   19   10   38                                       
CONECT    5    2    2    3   39                                       
CONECT    6   20   32   40   41                                       
CONECT    7    8    2   42   43                                       
CONECT    8   31    1    7   44                                       
CONECT    9   18   31   45   46                                       
CONECT   10    4    3    3   47                                       
CONECT   11   21   20   20   48                                       
CONECT   12   21   21   33   49                                       
CONECT   13   14   50   51   52                                       
CONECT   14   15   34   13   16                                       
CONECT   15   14   53   54   55                                       
CONECT   16   14   56   57   58                                       
CONECT   17   34   30   35   35                                       
CONECT   18   23   30    9   59                                       
CONECT   19    4    4    2   60                                       
CONECT   20   11   11   22    6                                       
CONECT   21   12   12   11   61                                       
CONECT   22   33   33   20   62                                       
CONECT   23   24   18   63   64                                       
CONECT   24   25   23   29   29                                       
CONECT   25   26   26   24   65                                       
CONECT   26   25   25   27   66                                       
CONECT   27   26   28   28   67                                       
CONECT   28   27   27   29   68                                       
CONECT   29   24   24   28   69                                       
CONECT   30   18   17   70                                            
CONECT   31    9    8   71                                            
CONECT   32    6    1   72                                            
CONECT   33   12   22   22                                            
CONECT   34   14   17                                                 
CONECT   35   17   17                                                 
CONECT   36    1    1                                                 
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   32                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
