COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.298   0.122  -2.938  1.00  0.00           C  
HETATM    2  C   UNL     1       1.066  -0.037  -3.213  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.170   0.384  -4.031  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.846   0.041  -1.649  1.00  0.00           C  
HETATM    5  N   UNL     1       2.060  -0.370  -2.302  1.00  0.00           N  
HETATM    6  C   UNL     1       1.527   0.173  -4.508  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.558   0.423  -3.823  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.660   0.599  -5.320  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.197   0.077  -1.464  1.00  0.00           C  
HETATM   10  C   UNL     1       3.489  -0.190  -2.642  1.00  0.00           C  
HETATM   11  C   UNL     1       1.973  -0.894  -1.075  1.00  0.00           C  
HETATM   12  C   UNL     1       0.674   0.500  -5.553  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.051   0.263  -2.575  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.793  -0.070  -0.295  1.00  0.00           O  
HETATM   15  C   UNL     1       4.172   0.114  -1.291  1.00  0.00           C  
HETATM   16  C   UNL     1       3.263  -0.678  -0.314  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.383   0.189   0.920  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.253  -0.277   1.944  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.236   0.861   1.299  1.00  0.00           C  
HETATM   20  C   UNL     1       1.868  -0.476   1.559  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.950  -0.077   3.285  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.455  -0.969   1.585  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.932   1.035   2.637  1.00  0.00           C  
HETATM   24  C   UNL     1       1.932  -0.208   3.038  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.786   0.572   3.620  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.408  -1.518   1.301  1.00  0.00           N  
HETATM   27  C   UNL     1       0.341   1.736   3.028  1.00  0.00           C  
HETATM   28  N   UNL     1       1.235   0.775   3.682  1.00  0.00           N  
HETATM   29  C   UNL     1       2.645  -0.861   3.968  1.00  0.00           C  
HETATM   30  C   UNL     1       1.530   0.685   4.994  1.00  0.00           C  
HETATM   31  N   UNL     1       2.381  -0.297   5.154  1.00  0.00           N  
HETATM   32  O   UNL     1       1.008  -1.483  -0.631  1.00  0.00           O  
HETATM   33  N   UNL     1       3.038   0.131   0.907  1.00  0.00           N  
HETATM   34  H   UNL     1      -0.202  -0.008  -0.783  1.00  0.00           H  
HETATM   35  H   UNL     1       2.583   0.070  -4.715  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.225   0.585  -4.659  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.332   0.845  -6.128  1.00  0.00           H  
HETATM   38  H   UNL     1       3.613   0.654  -3.320  1.00  0.00           H  
HETATM   39  H   UNL     1       3.891  -1.100  -3.081  1.00  0.00           H  
HETATM   40  H   UNL     1       1.068   0.677  -6.543  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.120   0.276  -2.419  1.00  0.00           H  
HETATM   42  H   UNL     1       4.147   1.182  -1.071  1.00  0.00           H  
HETATM   43  H   UNL     1       5.195  -0.262  -1.272  1.00  0.00           H  
HETATM   44  H   UNL     1       3.727  -1.616  -0.036  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.572   1.270   0.550  1.00  0.00           H  
HETATM   46  H   UNL     1       1.882  -1.548   1.385  1.00  0.00           H  
HETATM   47  H   UNL     1       0.969  -0.024   1.146  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.629  -0.422   4.054  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.540   0.717   4.662  1.00  0.00           H  
HETATM   50  H   UNL     1       0.822   2.139   2.137  1.00  0.00           H  
HETATM   51  H   UNL     1       0.114   2.549   3.715  1.00  0.00           H  
HETATM   52  H   UNL     1       3.309  -1.694   3.785  1.00  0.00           H  
HETATM   53  H   UNL     1       1.138   1.317   5.776  1.00  0.00           H  
HETATM   54  H   UNL     1       3.809  -0.200   1.523  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1    5    6                                       
CONECT    3    1    7    8    8                                       
CONECT    4    1    9    9   34                                       
CONECT    5    2   10   11                                            
CONECT    6    2   12   12   35                                       
CONECT    7    3   13   13   36                                       
CONECT    8    3    3   12   37                                       
CONECT    9    4    4   13   14                                       
CONECT   10    5   15   38   39                                       
CONECT   11    5   16   32   32                                       
CONECT   12    6    6    8   40                                       
CONECT   13    7    7    9   41                                       
CONECT   14    9   17                                                 
CONECT   15   10   16   42   43                                       
CONECT   16   11   15   33   44                                       
CONECT   17   14   18   18   19                                       
CONECT   18   17   17   21   22                                       
CONECT   19   17   23   23   45                                       
CONECT   20   24   33   46   47                                       
CONECT   21   18   25   25   48                                       
CONECT   22   18   26   26   26                                       
CONECT   23   19   19   25   27                                       
CONECT   24   20   28   29   29                                       
CONECT   25   21   21   23   49                                       
CONECT   26   22   22   22                                            
CONECT   27   23   28   50   51                                       
CONECT   28   24   27   30                                            
CONECT   29   24   24   31   52                                       
CONECT   30   28   31   31   53                                       
CONECT   31   29   30   30                                            
CONECT   32   11   11                                                 
CONECT   33   16   20   54                                            
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   33                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
