COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -6.031  -0.506  -0.142  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.665  -0.734   0.046  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.227  -2.030   0.308  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.379  -2.849   0.208  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.896  -1.589  -0.057  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.675  -0.111  -0.609  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.696   0.387  -0.034  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.341   0.146   0.149  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.273   2.728  -0.376  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.149   1.685  -0.299  1.00  0.00           C  
HETATM   11  C   UNL     1       0.011   1.357   0.200  1.00  0.00           C  
HETATM   12  C   UNL     1       4.680   0.124   0.896  1.00  0.00           C  
HETATM   13  C   UNL     1       5.683  -0.959   1.304  1.00  0.00           C  
HETATM   14  C   UNL     1       6.488   1.206  -0.445  1.00  0.00           C  
HETATM   15  C   UNL     1       9.728  -0.640  -0.197  1.00  0.00           C  
HETATM   16  C   UNL     1      10.285  -2.534  -1.556  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.084  -3.028   0.379  1.00  0.00           N  
HETATM   18  O   UNL     1      -8.233  -1.416  -0.232  1.00  0.00           O  
HETATM   19  C   UNL     1     -10.021  -0.216  -1.328  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.831   0.756   0.642  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.445   1.206   0.071  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.911   2.510  -0.191  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.800   3.313  -0.204  1.00  0.00           N  
HETATM   24  N   UNL     1       0.267   2.635   0.019  1.00  0.00           N  
HETATM   25  C   UNL     1       0.989   0.291   0.478  1.00  0.00           C  
HETATM   26  N   UNL     1       2.301   0.586   0.568  1.00  0.00           N  
HETATM   27  C   UNL     1       3.273  -0.474   0.845  1.00  0.00           C  
HETATM   28  C   UNL     1       7.095  -0.369   1.294  1.00  0.00           C  
HETATM   29  N   UNL     1       7.408   0.132  -0.051  1.00  0.00           N  
HETATM   30  C   UNL     1       5.057   0.665  -0.487  1.00  0.00           C  
HETATM   31  C   UNL     1       8.805   0.579  -0.133  1.00  0.00           C  
HETATM   32  O   UNL     1       9.471  -1.370  -1.398  1.00  0.00           O  
HETATM   33  O   UNL     1       0.612  -0.856   0.626  1.00  0.00           O  
HETATM   34  H   UNL     1      -6.404   0.488  -0.342  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.174  -2.218   0.455  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.046  -3.695   0.274  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.941   0.343  -1.276  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.987  -0.854   0.350  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.637   3.724  -0.581  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.205   1.862  -0.444  1.00  0.00           H  
HETATM   41  H   UNL     1       4.705   0.936   1.623  1.00  0.00           H  
HETATM   42  H   UNL     1       5.445  -1.316   2.305  1.00  0.00           H  
HETATM   43  H   UNL     1       5.629  -1.788   0.599  1.00  0.00           H  
HETATM   44  H   UNL     1       6.548   2.018   0.280  1.00  0.00           H  
HETATM   45  H   UNL     1       6.764   1.578  -1.432  1.00  0.00           H  
HETATM   46  H   UNL     1      10.767  -0.310  -0.187  1.00  0.00           H  
HETATM   47  H   UNL     1       9.542  -1.281   0.665  1.00  0.00           H  
HETATM   48  H   UNL     1      10.029  -3.032  -2.491  1.00  0.00           H  
HETATM   49  H   UNL     1      11.335  -2.244  -1.575  1.00  0.00           H  
HETATM   50  H   UNL     1      10.111  -3.215  -0.723  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.755  -0.669  -0.662  1.00  0.00           H  
HETATM   52  H   UNL     1     -10.358   0.780  -1.616  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.910  -0.834  -2.220  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.872   0.831   1.154  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.168   1.752   0.354  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.565   0.303   1.309  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.817   4.270  -0.362  1.00  0.00           H  
HETATM   58  H   UNL     1       2.601   1.501   0.451  1.00  0.00           H  
HETATM   59  H   UNL     1       3.226  -1.225   0.056  1.00  0.00           H  
HETATM   60  H   UNL     1       3.041  -0.939   1.803  1.00  0.00           H  
HETATM   61  H   UNL     1       7.151   0.451   2.009  1.00  0.00           H  
HETATM   62  H   UNL     1       7.813  -1.142   1.570  1.00  0.00           H  
HETATM   63  H   UNL     1       4.993  -0.139  -1.220  1.00  0.00           H  
HETATM   64  H   UNL     1       4.373   1.467  -0.765  1.00  0.00           H  
HETATM   65  H   UNL     1       9.049   1.174   0.747  1.00  0.00           H  
HETATM   66  H   UNL     1       8.941   1.184  -1.030  1.00  0.00           H  
CONECT    1    5    5    2   34                                       
CONECT    2    1    7    3    3                                       
CONECT    3    2    2   17   35                                       
CONECT    4    5   17   17   36                                       
CONECT    5   18    1    1    4                                       
CONECT    6   19   18   20   37                                       
CONECT    7    8    2   10   10                                       
CONECT    8   21   21    7   38                                       
CONECT    9   22   22   10   39                                       
CONECT   10    7    7    9   40                                       
CONECT   11   25   24   24   21                                       
CONECT   12   13   30   27   41                                       
CONECT   13   28   12   42   43                                       
CONECT   14   29   30   44   45                                       
CONECT   15   32   31   46   47                                       
CONECT   16   32   48   49   50                                       
CONECT   17    4    4    3                                            
CONECT   18    6    5                                                 
CONECT   19    6   51   52   53                                       
CONECT   20    6   54   55   56                                       
CONECT   21   11    8    8   22                                       
CONECT   22   21   23    9    9                                       
CONECT   23   24   22   57                                            
CONECT   24   11   11   23                                            
CONECT   25   26   33   33   11                                       
CONECT   26   27   25   58                                            
CONECT   27   12   26   59   60                                       
CONECT   28   29   13   61   62                                       
CONECT   29   31   28   14                                            
CONECT   30   14   12   63   64                                       
CONECT   31   15   29   65   66                                       
CONECT   32   16   15                                                 
CONECT   33   25   25                                                 
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
