COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.569   1.234   0.327  1.00  0.00           C  
HETATM    2  C   UNL     1       4.402  -0.723  -1.258  1.00  0.00           C  
HETATM    3  C   UNL     1       5.752  -0.467  -1.365  1.00  0.00           C  
HETATM    4  C   UNL     1       2.170  -0.264  -0.245  1.00  0.00           C  
HETATM    5  C   UNL     1       0.368  -1.793   0.180  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.344  -0.183   0.022  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.730  -0.142   0.067  1.00  0.00           C  
HETATM    8  C   UNL     1       3.623   0.009  -0.363  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.171  -0.613   0.039  1.00  0.00           C  
HETATM   10  C   UNL     1       3.225   0.971   2.707  1.00  0.00           C  
HETATM   11  C   UNL     1       3.381   1.772   1.413  1.00  0.00           C  
HETATM   12  C   UNL     1       4.217   0.987   0.435  1.00  0.00           C  
HETATM   13  C   UNL     1       6.339   0.511  -0.573  1.00  0.00           C  
HETATM   14  C   UNL     1       1.248   0.769  -0.455  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.090   0.533  -0.352  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.550  -0.748  -0.033  1.00  0.00           C  
HETATM   17  C   UNL     1       1.731  -1.543   0.066  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.365  -2.917   0.471  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.727  -2.597   0.454  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.885  -1.328   0.158  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.406  -1.178   0.222  1.00  0.00           N  
HETATM   22  C   UNL     1      -7.388   1.042  -0.189  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.674   2.193  -0.492  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.309   2.173  -0.541  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.620   0.982  -0.290  1.00  0.00           C  
HETATM   26  N   UNL     1      -3.305   0.655  -0.266  1.00  0.00           N  
HETATM   27  O   UNL     1       7.671   0.762  -0.680  1.00  0.00           O  
HETATM   28  H   UNL     1       6.029   1.995   0.941  1.00  0.00           H  
HETATM   29  H   UNL     1       3.947  -1.490  -1.868  1.00  0.00           H  
HETATM   30  H   UNL     1       6.356  -1.034  -2.058  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.291  -1.035   0.302  1.00  0.00           H  
HETATM   32  H   UNL     1       2.786  -0.001   2.482  1.00  0.00           H  
HETATM   33  H   UNL     1       4.202   0.831   3.168  1.00  0.00           H  
HETATM   34  H   UNL     1       2.575   1.514   3.393  1.00  0.00           H  
HETATM   35  H   UNL     1       2.398   1.961   0.981  1.00  0.00           H  
HETATM   36  H   UNL     1       3.872   2.721   1.629  1.00  0.00           H  
HETATM   37  H   UNL     1       1.600   1.760  -0.701  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.794   1.335  -0.515  1.00  0.00           H  
HETATM   39  H   UNL     1       2.445  -2.338   0.227  1.00  0.00           H  
HETATM   40  H   UNL     1       0.003  -3.793   0.665  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.588  -2.103   0.450  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.467   1.074  -0.154  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.203   3.113  -0.692  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.764   3.074  -0.778  1.00  0.00           H  
HETATM   45  H   UNL     1       8.220   0.231  -0.087  1.00  0.00           H  
CONECT    1   12   13   13   28                                       
CONECT    2    8    3    3   29                                       
CONECT    3    2    2   13   30                                       
CONECT    4   17   17   14    8                                       
CONECT    5   18   16   16   17                                       
CONECT    6   25   25    7   21                                       
CONECT    7   22   22    6   31                                       
CONECT    8    4   12   12    2                                       
CONECT    9   26   26   20   21                                       
CONECT   10   11   32   33   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11    8    8    1                                       
CONECT   13    1    1    3   27                                       
CONECT   14   15   15    4   37                                       
CONECT   15   16   14   14   38                                       
CONECT   16   20    5    5   15                                       
CONECT   17    5    4    4   39                                       
CONECT   18   19    5   40                                            
CONECT   19   18   20   20                                            
CONECT   20   19   19    9   16                                       
CONECT   21    9    6   41                                            
CONECT   22   23    7    7   42                                       
CONECT   23   24   24   22   43                                       
CONECT   24   23   23   25   44                                       
CONECT   25   24   26    6    6                                       
CONECT   26   25    9    9                                            
CONECT   27   13   45                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
