COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.005   3.065  -0.146  1.00  0.00           C  
HETATM    2  C   UNL     1       1.324   1.109   0.485  1.00  0.00           C  
HETATM    3  C   UNL     1       1.255   2.464   0.101  1.00  0.00           C  
HETATM    4  C   UNL     1       1.014   5.078  -0.640  1.00  0.00           C  
HETATM    5  C   UNL     1       2.247  -1.107   2.482  1.00  0.00           C  
HETATM    6  C   UNL     1       4.221  -1.240  -0.856  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.306   0.155   0.516  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.668  -0.353   1.787  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.794  -1.100   1.915  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.167  -1.269  -1.323  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.074   0.967   0.367  1.00  0.00           C  
HETATM   12  C   UNL     1       2.282   4.547  -0.417  1.00  0.00           C  
HETATM   13  C   UNL     1       2.530  -0.873   0.997  1.00  0.00           C  
HETATM   14  C   UNL     1       3.898  -1.458   0.641  1.00  0.00           C  
HETATM   15  C   UNL     1       4.943  -2.504  -1.268  1.00  0.00           C  
HETATM   16  C   UNL     1       3.882  -3.000   0.738  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.170   2.296  -0.005  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.085  -0.104  -0.570  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.587  -1.357   0.779  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.207  -0.972  -2.800  1.00  0.00           C  
HETATM   21  C   UNL     1       0.177   0.382   0.615  1.00  0.00           C  
HETATM   22  C   UNL     1       2.418   3.240  -0.042  1.00  0.00           C  
HETATM   23  N   UNL     1       4.741  -3.470  -0.356  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.215  -0.853  -0.444  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.709  -2.033   0.589  1.00  0.00           N  
HETATM   26  N   UNL     1      -6.041  -1.974  -0.652  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.070   4.352  -0.505  1.00  0.00           N  
HETATM   28  O   UNL     1       5.607  -2.627  -2.275  1.00  0.00           O  
HETATM   29  O   UNL     1       2.528   0.530   0.728  1.00  0.00           O  
HETATM   30  H   UNL     1       0.921   6.114  -0.931  1.00  0.00           H  
HETATM   31  H   UNL     1       2.249  -2.178   2.688  1.00  0.00           H  
HETATM   32  H   UNL     1       3.017  -0.621   3.080  1.00  0.00           H  
HETATM   33  H   UNL     1       1.272  -0.691   2.736  1.00  0.00           H  
HETATM   34  H   UNL     1       3.302  -1.121  -1.431  1.00  0.00           H  
HETATM   35  H   UNL     1       4.867  -0.372  -0.984  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.051  -0.148   2.649  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.080  -1.493   2.880  1.00  0.00           H  
HETATM   38  H   UNL     1       3.157   5.169  -0.536  1.00  0.00           H  
HETATM   39  H   UNL     1       1.760  -1.360   0.399  1.00  0.00           H  
HETATM   40  H   UNL     1       4.679  -1.035   1.273  1.00  0.00           H  
HETATM   41  H   UNL     1       4.285  -3.322   1.698  1.00  0.00           H  
HETATM   42  H   UNL     1       2.868  -3.376   0.609  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.138   2.740  -0.185  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.804   0.286  -1.537  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.762  -0.050  -2.970  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.190  -0.859  -3.175  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.698  -1.793  -3.323  1.00  0.00           H  
HETATM   48  H   UNL     1       0.232  -0.656   0.909  1.00  0.00           H  
HETATM   49  H   UNL     1       3.394   2.814   0.139  1.00  0.00           H  
HETATM   50  H   UNL     1       5.115  -4.363  -0.413  1.00  0.00           H  
CONECT    1    3    3   17   27                                       
CONECT    2   29   21   21    3                                       
CONECT    3    2   22    1    1                                       
CONECT    4   12   27   27   30                                       
CONECT    5   13   31   32   33                                       
CONECT    6   14   15   34   35                                       
CONECT    7    8   11   18   18                                       
CONECT    8    9    9    7   36                                       
CONECT    9    8    8   19   37                                       
CONECT   10   24   26   26   20                                       
CONECT   11   21    7   17   17                                       
CONECT   12   22   22    4   38                                       
CONECT   13   14    5   29   39                                       
CONECT   14    6   16   13   40                                       
CONECT   15    6   23   28   28                                       
CONECT   16   14   23   41   42                                       
CONECT   17   11   11    1   43                                       
CONECT   18    7    7   24   44                                       
CONECT   19    9   24   25   25                                       
CONECT   20   10   45   46   47                                       
CONECT   21    2    2   11   48                                       
CONECT   22    3   12   12   49                                       
CONECT   23   16   15   50                                            
CONECT   24   19   18   10                                            
CONECT   25   19   19   26                                            
CONECT   26   25   10   10                                            
CONECT   27    1    4    4                                            
CONECT   28   15   15                                                 
CONECT   29   13    2                                                 
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
