COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.888  -2.600   1.396  1.00  0.00           C  
HETATM    2  C   UNL     1       4.537  -2.495   1.698  1.00  0.00           C  
HETATM    3  C   UNL     1       6.499  -1.675   0.599  1.00  0.00           C  
HETATM    4  C   UNL     1       4.391  -0.502   0.382  1.00  0.00           C  
HETATM    5  C   UNL     1       0.375   0.822  -0.468  1.00  0.00           C  
HETATM    6  C   UNL     1       2.640   1.137  -0.249  1.00  0.00           C  
HETATM    7  C   UNL     1       2.420   2.500  -0.010  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.778  -0.078  -0.717  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.819  -0.748  -0.990  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.436  -0.496   1.314  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.356   0.058  -0.051  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.998   0.377   2.438  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.899   0.925   1.088  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.322  -0.744  -1.093  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.066   0.289  -0.736  1.00  0.00           N  
HETATM   16  N   UNL     1       5.046   1.171  -0.935  1.00  0.00           N  
HETATM   17  N   UNL     1       3.942   0.629  -0.262  1.00  0.00           N  
HETATM   18  N   UNL     1       3.498   3.349   0.212  1.00  0.00           N  
HETATM   19  C   UNL     1       3.788  -1.454   1.196  1.00  0.00           C  
HETATM   20  C   UNL     1       0.160   2.175  -0.220  1.00  0.00           C  
HETATM   21  C   UNL     1       5.760  -0.607   0.077  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.740  -0.112  -2.422  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.444  -3.194  -1.431  1.00  0.00           C  
HETATM   24  N   UNL     1       1.184   2.979   0.002  1.00  0.00           N  
HETATM   25  N   UNL     1       6.081   0.438  -0.722  1.00  0.00           N  
HETATM   26  N   UNL     1       1.613   0.334  -0.476  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.704  -1.368  -0.963  1.00  0.00           N  
HETATM   28  N   UNL     1      -2.022  -1.822  -1.136  1.00  0.00           N  
HETATM   29  N   UNL     1      -4.887   0.033   0.018  1.00  0.00           N  
HETATM   30  O   UNL     1      -6.424   0.416   2.337  1.00  0.00           O  
HETATM   31  H   UNL     1       6.464  -3.420   1.800  1.00  0.00           H  
HETATM   32  H   UNL     1       4.070  -3.236   2.330  1.00  0.00           H  
HETATM   33  H   UNL     1       7.551  -1.768   0.372  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.346  -0.482   1.352  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.791  -1.519   1.434  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.743  -0.956   0.048  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.668   0.477  -1.007  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.713  -0.044   3.403  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.599   1.387   2.350  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.556   1.952   0.960  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.989   0.901   1.076  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.692  -1.768  -1.046  1.00  0.00           H  
HETATM   43  H   UNL     1       4.393   2.985   0.294  1.00  0.00           H  
HETATM   44  H   UNL     1       3.355   4.306   0.285  1.00  0.00           H  
HETATM   45  H   UNL     1       2.737  -1.378   1.433  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.846   2.568  -0.210  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.370   0.913  -2.470  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.321  -0.688  -3.247  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.827  -0.109  -2.497  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.475  -3.341  -2.510  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.737  -3.895  -0.988  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.436  -3.366  -1.013  1.00  0.00           H  
CONECT    1    2    2    3   31                                       
CONECT    2    1    1   19   32                                       
CONECT    3    1   21   21   33                                       
CONECT    4   19   19   21   17                                       
CONECT    5    8   26   26   20                                       
CONECT    6   26   17    7    7                                       
CONECT    7    6    6   24   18                                       
CONECT    8   15   27   27    5                                       
CONECT    9   14   15   15   28                                       
CONECT   10   29   12   34   35                                       
CONECT   11   13   29   36   37                                       
CONECT   12   30   10   38   39                                       
CONECT   13   11   30   40   41                                       
CONECT   14   22   29    9   42                                       
CONECT   15    9    9    8                                            
CONECT   16   25   25   17                                            
CONECT   17    4    6   16                                            
CONECT   18    7   43   44                                            
CONECT   19    2    4    4   45                                       
CONECT   20    5   24   24   46                                       
CONECT   21    3    3    4   25                                       
CONECT   22   14   47   48   49                                       
CONECT   23   28   50   51   52                                       
CONECT   24   20   20    7                                            
CONECT   25   21   16   16                                            
CONECT   26    5    5    6                                            
CONECT   27   28    8    8                                            
CONECT   28    9   23   27                                            
CONECT   29   11   14   10                                            
CONECT   30   13   12                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
