COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.640  -0.163  -0.109  1.00  0.00           C  
HETATM    2  C   UNL     1       4.220   1.243  -1.041  1.00  0.00           C  
HETATM    3  C   UNL     1       3.283  -1.021  -0.442  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.027  -0.039  -1.320  1.00  0.00           C  
HETATM    5  C   UNL     1       7.608  -0.976   0.755  1.00  0.00           C  
HETATM    6  C   UNL     1       2.610  -0.957   0.939  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.346  -0.538  -0.450  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.887  -1.984  -0.344  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.348  -2.059   1.129  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.204  -2.589   1.992  1.00  0.00           C  
HETATM   11  C   UNL     1       1.103  -1.122   0.641  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.220   0.228   0.559  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.785   1.151   2.416  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.191   2.531   0.745  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.393   3.165   1.712  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.003   4.495   1.483  1.00  0.00           C  
HETATM   17  C   UNL     1       0.996  -1.096  -0.890  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.156   4.453  -0.516  1.00  0.00           C  
HETATM   19  C   UNL     1       6.280   1.057  -0.389  1.00  0.00           C  
HETATM   20  C   UNL     1       7.638   1.186  -0.054  1.00  0.00           C  
HETATM   21  N   UNL     1       8.321   2.363  -0.306  1.00  0.00           N  
HETATM   22  N   UNL     1       8.252   0.151   0.511  1.00  0.00           N  
HETATM   23  N   UNL     1       6.337  -1.142   0.458  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.426   1.265   1.218  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.179   2.266   2.704  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.406   5.089   0.365  1.00  0.00           N  
HETATM   27  N   UNL     1      -3.547   3.208  -0.343  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.217   5.170   2.400  1.00  0.00           N  
HETATM   29  N   UNL     1       5.357   1.870  -0.957  1.00  0.00           N  
HETATM   30  N   UNL     1       4.341  -0.013  -0.526  1.00  0.00           N  
HETATM   31  O   UNL     1      -0.985  -0.640  -2.196  1.00  0.00           O  
HETATM   32  O   UNL     1      -1.934   1.592  -2.910  1.00  0.00           O  
HETATM   33  O   UNL     1       3.071  -2.024   1.767  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.503  -0.027  -1.768  1.00  0.00           O  
HETATM   35  O   UNL     1      -4.997  -2.166  -1.223  1.00  0.00           O  
HETATM   36  O   UNL     1      -1.961  -2.069   1.514  1.00  0.00           O  
HETATM   37  O   UNL     1       0.638  -2.361   1.176  1.00  0.00           O  
HETATM   38  O   UNL     1      -1.012  -3.141  -0.567  1.00  0.00           O  
HETATM   39  O   UNL     1      -0.878  -4.463   1.574  1.00  0.00           O  
HETATM   40  O   UNL     1      -4.672  -0.723   1.526  1.00  0.00           O  
HETATM   41  O   UNL     1       2.281  -0.755  -1.422  1.00  0.00           O  
HETATM   42  O   UNL     1      -2.651  -0.443  -4.224  1.00  0.00           O  
HETATM   43  P   UNL     1      -2.260   0.155  -2.781  1.00  0.00           P  
HETATM   44  P   UNL     1      -0.806  -3.003   0.893  1.00  0.00           P  
HETATM   45  H   UNL     1       3.313   1.657  -1.457  1.00  0.00           H  
HETATM   46  H   UNL     1       3.702  -2.014  -0.602  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.531   0.360  -0.442  1.00  0.00           H  
HETATM   48  H   UNL     1       0.486   0.769  -1.843  1.00  0.00           H  
HETATM   49  H   UNL     1       8.146  -1.792   1.215  1.00  0.00           H  
HETATM   50  H   UNL     1       2.800   0.005   1.411  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.303  -0.508  -0.141  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.107  -2.708  -0.544  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.220  -2.701   1.210  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.355  -2.274   3.026  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.190  -3.677   1.947  1.00  0.00           H  
HETATM   56  H   UNL     1       0.547  -0.291   1.070  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.072   0.670   0.051  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.784   0.267   3.036  1.00  0.00           H  
HETATM   59  H   UNL     1       0.697  -2.072  -1.270  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.462   4.974  -1.411  1.00  0.00           H  
HETATM   61  H   UNL     1       7.862   3.111  -0.718  1.00  0.00           H  
HETATM   62  H   UNL     1       9.258   2.440  -0.070  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.929   4.726   3.213  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.954   6.089   2.231  1.00  0.00           H  
HETATM   65  H   UNL     1       4.022  -2.004   1.942  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.376  -3.055  -1.198  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.720  -4.919   1.438  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.947  -0.374  -4.882  1.00  0.00           H  
CONECT    1   30   23   23   19                                       
CONECT    2   30   29   29   45                                       
CONECT    3    6   30   41   46                                       
CONECT    4   17   31   47   48                                       
CONECT    5   23   22   22   49                                       
CONECT    6   33   11    3   50                                       
CONECT    7   12    8   34   51                                       
CONECT    8    9    7   35   52                                       
CONECT    9   10   40    8   53                                       
CONECT   10   36    9   54   55                                       
CONECT   11   37    6   17   56                                       
CONECT   12   40   24    7   57                                       
CONECT   13   25   25   24   58                                       
CONECT   14   15   24   27   27                                       
CONECT   15   25   16   16   14                                       
CONECT   16   28   15   15   26                                       
CONECT   17   11   41    4   59                                       
CONECT   18   26   26   27   60                                       
CONECT   19   29    1   20   20                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20   61   62                                            
CONECT   22    5    5   20                                            
CONECT   23    1    1    5                                            
CONECT   24   13   12   14                                            
CONECT   25   13   13   15                                            
CONECT   26   16   18   18                                            
CONECT   27   14   14   18                                            
CONECT   28   16   63   64                                            
CONECT   29    2    2   19                                            
CONECT   30    3    2    1                                            
CONECT   31   43    4                                                 
CONECT   32   43   43                                                 
CONECT   33    6   65                                                 
CONECT   34    7   43                                                 
CONECT   35    8   66                                                 
CONECT   36   10   44                                                 
CONECT   37   44   11                                                 
CONECT   38   44   44                                                 
CONECT   39   44   67                                                 
CONECT   40    9   12                                                 
CONECT   41    3   17                                                 
CONECT   42   43   68                                                 
CONECT   43   34   32   32   31                                       
CONECT   43   42                                                      
CONECT   44   38   38   36   39                                       
CONECT   44   37                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    7                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54   10                                                      
CONECT   55   10                                                      
CONECT   56   11                                                      
CONECT   57   12                                                      
CONECT   58   13                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
CONECT   67   39                                                      
CONECT   68   42                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
