COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.112  -0.717   0.122  1.00  0.00           C  
HETATM    2  C   UNL     1       3.759  -2.496  -0.072  1.00  0.00           C  
HETATM    3  N   UNL     1       1.065  -2.718  -0.259  1.00  0.00           N  
HETATM    4  C   UNL     1       1.564  -1.489  -0.166  1.00  0.00           C  
HETATM    5  C   UNL     1       2.956  -1.341  -0.065  1.00  0.00           C  
HETATM    6  C   UNL     1       3.870  -0.209   0.066  1.00  0.00           C  
HETATM    7  C   UNL     1       3.493   1.249   0.127  1.00  0.00           C  
HETATM    8  C   UNL     1       4.032   1.971  -1.112  1.00  0.00           C  
HETATM    9  C   UNL     1       3.713   3.464  -1.003  1.00  0.00           C  
HETATM   10  C   UNL     1       3.778   3.380   1.395  1.00  0.00           C  
HETATM   11  C   UNL     1       4.100   1.884   1.382  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.895  -1.060   0.704  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.478   0.239   0.144  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.791   0.577  -1.181  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.289   0.750  -0.947  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.920   0.073  -0.080  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.499   1.274  -0.699  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.101  -0.476   0.885  1.00  0.00           C  
HETATM   19  N   UNL     1       5.059  -2.084   0.036  1.00  0.00           N  
HETATM   20  N   UNL     1       3.166  -3.684  -0.182  1.00  0.00           N  
HETATM   21  C   UNL     1       1.857  -3.775  -0.271  1.00  0.00           C  
HETATM   22  O   UNL     1       4.282   3.985   0.200  1.00  0.00           O  
HETATM   23  N   UNL     1       0.732  -0.384  -0.163  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.706  -0.550  -0.387  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.393  -0.887   0.938  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.987   1.036  -0.969  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.639   0.690   0.256  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.614  -0.253   1.174  1.00  0.00           C  
HETATM   29  H   UNL     1       6.017  -0.135   0.215  1.00  0.00           H  
HETATM   30  H   UNL     1       2.407   1.343   0.160  1.00  0.00           H  
HETATM   31  H   UNL     1       5.112   1.833  -1.172  1.00  0.00           H  
HETATM   32  H   UNL     1       3.563   1.561  -2.006  1.00  0.00           H  
HETATM   33  H   UNL     1       4.132   3.989  -1.861  1.00  0.00           H  
HETATM   34  H   UNL     1       2.632   3.603  -0.984  1.00  0.00           H  
HETATM   35  H   UNL     1       2.697   3.519   1.444  1.00  0.00           H  
HETATM   36  H   UNL     1       4.244   3.845   2.263  1.00  0.00           H  
HETATM   37  H   UNL     1       3.679   1.413   2.270  1.00  0.00           H  
HETATM   38  H   UNL     1       5.181   1.744   1.373  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.385  -1.301   1.648  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.062  -1.869  -0.007  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.311   1.048   0.856  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.957  -0.232  -1.892  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.206   1.502  -1.579  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.799   0.990  -1.891  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.123   1.559  -0.235  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.382   2.123  -0.025  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.986   1.483  -1.638  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.629  -0.661   1.820  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.218  -1.334   0.224  1.00  0.00           H  
HETATM   50  H   UNL     1       5.830  -2.673   0.050  1.00  0.00           H  
HETATM   51  H   UNL     1       1.410  -4.755  -0.348  1.00  0.00           H  
HETATM   52  H   UNL     1       1.100   0.501  -0.013  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.873  -1.358  -1.099  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.227  -0.078   1.650  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.979  -1.813   1.337  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.433   1.944  -1.375  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.101   0.222  -1.685  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.186  -1.160   1.602  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.500   0.572   1.878  1.00  0.00           H  
CONECT    1    6    6   19   29                                       
CONECT    2    5   19   20   20                                       
CONECT    3    4   21   21                                            
CONECT    4   23    5    5    3                                       
CONECT    5    6    4    4    2                                       
CONECT    6    7    5    1    1                                       
CONECT    7   11    8    6   30                                       
CONECT    8    9    7   31   32                                       
CONECT    9   22    8   33   34                                       
CONECT   10   22   11   35   36                                       
CONECT   11   10    7   37   38                                       
CONECT   12   13   25   39   40                                       
CONECT   13   16   14   12   41                                       
CONECT   14   13   15   42   43                                       
CONECT   15   14   24   44   45                                       
CONECT   16   17   13   28                                            
CONECT   17   26   16   46   47                                       
CONECT   18   27   28   48   49                                       
CONECT   19    1    2   50                                            
CONECT   20    2    2   21                                            
CONECT   21    3    3   20   51                                       
CONECT   22   10    9                                                 
CONECT   23   24    4   52                                            
CONECT   24   15   25   23   53                                       
CONECT   25   12   24   54   55                                       
CONECT   26   17   27   56   57                                       
CONECT   27   26   18                                                 
CONECT   28   16   18   58   59                                       
CONECT   29    1                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
