COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.709   2.107  -0.694  1.00  0.00           N  
HETATM    2  C   UNL     1       1.796   3.024   1.548  1.00  0.00           C  
HETATM    3  O   UNL     1       1.880  -1.423  -0.087  1.00  0.00           O  
HETATM    4  N   UNL     1       3.799  -0.600   0.669  1.00  0.00           N  
HETATM    5  C   UNL     1       1.773   0.775   0.699  1.00  0.00           C  
HETATM    6  N   UNL     1       4.898  -4.030   1.474  1.00  0.00           N  
HETATM    7  C   UNL     1       0.411   0.894   0.422  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.247   2.081   0.705  1.00  0.00           C  
HETATM    9  C   UNL     1       2.483  -0.487   0.400  1.00  0.00           C  
HETATM   10  C   UNL     1       4.503  -1.851   0.373  1.00  0.00           C  
HETATM   11  C   UNL     1       4.333  -2.807   1.525  1.00  0.00           C  
HETATM   12  O   UNL     1       3.688  -2.477   2.497  1.00  0.00           O  
HETATM   13  C   UNL     1       5.990  -1.562   0.165  1.00  0.00           C  
HETATM   14  C   UNL     1       6.172  -0.691  -1.080  1.00  0.00           C  
HETATM   15  C   UNL     1       7.660  -0.402  -1.288  1.00  0.00           C  
HETATM   16  C   UNL     1       8.183   0.442  -0.124  1.00  0.00           C  
HETATM   17  C   UNL     1       9.671   0.730  -0.333  1.00  0.00           C  
HETATM   18  C   UNL     1       9.864   1.495  -1.644  1.00  0.00           C  
HETATM   19  C   UNL     1       9.340   0.651  -2.808  1.00  0.00           C  
HETATM   20  C   UNL     1       7.852   0.362  -2.600  1.00  0.00           C  
HETATM   21  C   UNL     1       2.462   1.849   1.265  1.00  0.00           C  
HETATM   22  C   UNL     1       0.447   3.143   1.273  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.274   4.427   1.590  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.613   2.205   0.429  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.393   1.107   0.376  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.932   0.020   0.666  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.804   1.225  -0.033  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.717   0.194  -0.133  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.455  -1.262   0.157  1.00  0.00           C  
HETATM   30  F   UNL     1      -4.024  -1.900  -1.011  1.00  0.00           F  
HETATM   31  F   UNL     1      -3.464  -1.370   1.140  1.00  0.00           F  
HETATM   32  F   UNL     1      -5.631  -1.866   0.612  1.00  0.00           F  
HETATM   33  N   UNL     1      -5.884   0.728  -0.537  1.00  0.00           N  
HETATM   34  C   UNL     1      -4.476   2.414  -0.397  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.074   0.022  -0.762  1.00  0.00           C  
HETATM   36  C   UNL     1      -7.031  -1.267  -1.275  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.206  -1.960  -1.495  1.00  0.00           C  
HETATM   38  C   UNL     1      -9.422  -1.371  -1.205  1.00  0.00           C  
HETATM   39  C   UNL     1      -9.468  -0.087  -0.694  1.00  0.00           C  
HETATM   40  C   UNL     1      -8.297   0.609  -0.466  1.00  0.00           C  
HETATM   41  H   UNL     1       2.330   3.853   1.989  1.00  0.00           H  
HETATM   42  H   UNL     1       4.280   0.147   1.058  1.00  0.00           H  
HETATM   43  H   UNL     1       5.414  -4.294   0.697  1.00  0.00           H  
HETATM   44  H   UNL     1       4.789  -4.646   2.216  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.128   0.065  -0.011  1.00  0.00           H  
HETATM   46  H   UNL     1       4.089  -2.295  -0.532  1.00  0.00           H  
HETATM   47  H   UNL     1       6.384  -1.037   1.036  1.00  0.00           H  
HETATM   48  H   UNL     1       6.528  -2.501   0.033  1.00  0.00           H  
HETATM   49  H   UNL     1       5.778  -1.215  -1.951  1.00  0.00           H  
HETATM   50  H   UNL     1       5.634   0.248  -0.948  1.00  0.00           H  
HETATM   51  H   UNL     1       8.210  -1.342  -1.332  1.00  0.00           H  
HETATM   52  H   UNL     1       7.633   1.382  -0.081  1.00  0.00           H  
HETATM   53  H   UNL     1       8.046  -0.103   0.810  1.00  0.00           H  
HETATM   54  H   UNL     1      10.044   1.332   0.497  1.00  0.00           H  
HETATM   55  H   UNL     1      10.221  -0.210  -0.376  1.00  0.00           H  
HETATM   56  H   UNL     1       9.314   2.435  -1.600  1.00  0.00           H  
HETATM   57  H   UNL     1      10.924   1.701  -1.792  1.00  0.00           H  
HETATM   58  H   UNL     1       9.477   1.196  -3.742  1.00  0.00           H  
HETATM   59  H   UNL     1       9.890  -0.289  -2.851  1.00  0.00           H  
HETATM   60  H   UNL     1       7.479  -0.239  -3.429  1.00  0.00           H  
HETATM   61  H   UNL     1       7.302   1.302  -2.556  1.00  0.00           H  
HETATM   62  H   UNL     1       3.517   1.761   1.480  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.226   5.094   0.729  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.317   4.210   1.824  1.00  0.00           H  
HETATM   65  H   UNL     1       0.198   4.907   2.448  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.999   3.082   0.276  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.044   3.403  -0.425  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.081  -1.728  -1.502  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.173  -2.963  -1.895  1.00  0.00           H  
HETATM   70  H   UNL     1     -10.340  -1.915  -1.379  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.420   0.371  -0.469  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.333   1.610  -0.062  1.00  0.00           H  
CONECT    1   34   34   33                                            
CONECT    2   21   22   22   41                                       
CONECT    3    9    9                                                 
CONECT    4   10    9   42                                            
CONECT    5    9   21   21    7                                       
CONECT    6   11   43   44                                            
CONECT    7    5    8    8   45                                       
CONECT    8    7    7   22   24                                       
CONECT    9    4    3    3    5                                       
CONECT   10   13   11    4   46                                       
CONECT   11   12   12   10    6                                       
CONECT   12   11   11                                                 
CONECT   13   14   10   47   48                                       
CONECT   14   15   13   49   50                                       
CONECT   15   16   14   20   51                                       
CONECT   16   17   15   52   53                                       
CONECT   17   16   18   54   55                                       
CONECT   18   17   19   56   57                                       
CONECT   19   18   20   58   59                                       
CONECT   20   15   19   60   61                                       
CONECT   21    5    5    2   62                                       
CONECT   22    2    2    8   23                                       
CONECT   23   22   63   64   65                                       
CONECT   24    8   25   66                                            
CONECT   25   24   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   34   28   28                                       
CONECT   28   27   27   33   29                                       
CONECT   29   28   31   32   30                                       
CONECT   30   29                                                      
CONECT   31   29                                                      
CONECT   32   29                                                      
CONECT   33    1   28   35                                            
CONECT   34   27    1    1   67                                       
CONECT   35   33   40   40   36                                       
CONECT   36   35   37   37   68                                       
CONECT   37   36   36   38   69                                       
CONECT   38   39   39   37   70                                       
CONECT   39   40   38   38   71                                       
CONECT   40   35   35   39   72                                       
CONECT   41    2                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46   10                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   21                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   34                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
CONECT   72   40                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
