COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.386   0.374  -0.530  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.292   0.216  -0.710  1.00  0.00           C  
HETATM    3  C   UNL     1       1.280  -1.902  -0.371  1.00  0.00           C  
HETATM    4  C   UNL     1       0.318   1.343   0.657  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.699   0.885  -0.581  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.435  -1.764   0.005  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.396   2.379  -0.883  1.00  0.00           C  
HETATM    8  C   UNL     1       1.578   2.214   0.556  1.00  0.00           C  
HETATM    9  C   UNL     1       0.755  -3.111   1.665  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.864   2.500  -0.804  1.00  0.00           C  
HETATM   11  C   UNL     1       2.432   1.547  -0.536  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.241  -3.795  -0.609  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.389  -2.465   1.949  1.00  0.00           C  
HETATM   14  C   UNL     1       3.613   0.815   0.102  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.155  -2.695   3.232  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.774  -4.014  -1.024  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.481   3.635   0.126  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.985  -3.293  -0.503  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.798  -1.445   0.832  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.057  -1.943   0.232  1.00  0.00           C  
HETATM   21  N   UNL     1       0.301  -1.007  -0.045  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.206  -1.104  -0.163  1.00  0.00           N  
HETATM   23  N   UNL     1       1.506  -2.888   0.526  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.357  -3.097  -0.195  1.00  0.00           N  
HETATM   25  O   UNL     1       1.954  -1.801  -1.378  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.494  -1.235   0.252  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.853   2.719  -2.194  1.00  0.00           O  
HETATM   28  O   UNL     1       1.259   3.560   0.182  1.00  0.00           O  
HETATM   29  O   UNL     1       1.199  -4.040   2.553  1.00  0.00           O1-
HETATM   30  O   UNL     1       1.597   0.620  -1.230  1.00  0.00           O  
HETATM   31  O   UNL     1      -0.387   3.760   2.095  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.367   1.236  -0.301  1.00  0.00           O  
HETATM   33  O   UNL     1      -3.396  -5.033  -1.144  1.00  0.00           O1-
HETATM   34  O   UNL     1       4.463   0.298  -0.923  1.00  0.00           O  
HETATM   35  O   UNL     1       0.366   5.901   0.989  1.00  0.00           O  
HETATM   36  O   UNL     1      -1.234   4.214  -0.250  1.00  0.00           O  
HETATM   37  O   UNL     1       6.685   0.264   0.275  1.00  0.00           O  
HETATM   38  O   UNL     1       5.426  -1.918   0.115  1.00  0.00           O  
HETATM   39  P   UNL     1       5.807  -0.532  -0.611  1.00  0.00           P  
HETATM   40  P   UNL     1      -0.007   4.346   0.792  1.00  0.00           P  
HETATM   41  H   UNL     1      -0.466   0.513  -1.193  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.170   0.099  -1.826  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.576   1.958   0.590  1.00  0.00           H  
HETATM   44  H   UNL     1       0.325   0.788   1.597  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.393   0.481  -1.312  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.083   0.785   0.435  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.869   3.019  -0.140  1.00  0.00           H  
HETATM   48  H   UNL     1       2.120   2.241   1.498  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.473   2.661  -1.814  1.00  0.00           H  
HETATM   50  H   UNL     1       2.798   2.307  -1.226  1.00  0.00           H  
HETATM   51  H   UNL     1       4.176   1.510   0.726  1.00  0.00           H  
HETATM   52  H   UNL     1       3.243  -0.006   0.716  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.634  -3.435   3.839  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.227  -1.758   3.784  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.156  -3.057   2.997  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.079  -4.958  -1.474  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.278  -3.397  -1.773  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.086  -4.209  -0.201  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.254   4.404   0.083  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.414   3.256   1.146  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.021  -0.545   1.442  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.581  -2.372   1.158  1.00  0.00           H  
HETATM   63  H   UNL     1       2.255  -3.484   0.355  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.166  -3.605  -0.028  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.806   2.616  -2.318  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.354   6.435   1.354  1.00  0.00           H  
HETATM   67  H   UNL     1       4.852  -2.492  -0.410  1.00  0.00           H  
HETATM   68  O   UNL     1       6.578  -0.843  -1.990  1.00  0.00           O  
HETATM   69  H   UNL     1       7.399  -1.342  -1.879  1.00  0.00           H  
CONECT    1   21   30    4   41                                       
CONECT    2   22    5   32   42                                       
CONECT    3   23   21   25   25                                       
CONECT    4    1    8   43   44                                       
CONECT    5    2    7   45   46                                       
CONECT    6   24   22   26   26                                       
CONECT    7    5   10   27   47                                       
CONECT    8   11    4   28   48                                       
CONECT    9   29   13   13   23                                       
CONECT   10   32    7   17   49                                       
CONECT   11   14   30    8   50                                       
CONECT   12   33   18   18   24                                       
CONECT   13   15    9    9   19                                       
CONECT   14   34   11   51   52                                       
CONECT   15   13   53   54   55                                       
CONECT   16   18   56   57   58                                       
CONECT   17   36   10   59   60                                       
CONECT   18   16   12   12   20                                       
CONECT   19   13   20   21   61                                       
CONECT   20   18   19   22   62                                       
CONECT   21   19    3    1                                            
CONECT   22   20    6    2                                            
CONECT   23    9    3   63                                            
CONECT   24   12    6   64                                            
CONECT   25    3    3                                                 
CONECT   26    6    6                                                 
CONECT   27    7   65                                                 
CONECT   28    8   40                                                 
CONECT   29    9                                                      
CONECT   30   11    1                                                 
CONECT   31   40   40                                                 
CONECT   32    2   10                                                 
CONECT   33   12                                                      
CONECT   34   14   39                                                 
CONECT   35   40   66                                                 
CONECT   36   40   17                                                 
CONECT   37   39   39                                                 
CONECT   38   39   67                                                 
CONECT   39   37   37   34   38                                       
CONECT   39   68                                                      
CONECT   40   28   31   31   36                                       
CONECT   40   35                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   27                                                      
CONECT   66   35                                                      
CONECT   67   38                                                      
CONECT   68   39   69                                                 
CONECT   69   68                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
