COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.755  -1.014  -0.242  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.118  -0.823  -0.187  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.205  -1.653  -0.444  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.487  -1.174  -0.301  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.711   0.141   0.103  1.00  0.00           C  
HETATM    6  O   UNL     1      -8.985   0.598   0.240  1.00  0.00           O  
HETATM    7  C   UNL     1     -10.039  -0.323  -0.046  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.650   0.981   0.364  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.339   0.507   0.221  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.066   1.099   0.406  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.126   0.161   0.120  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.672   0.363   0.186  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.223   1.444   0.519  1.00  0.00           O  
HETATM   14  N   UNL     1      -0.836  -0.648  -0.123  1.00  0.00           N  
HETATM   15  C   UNL     1       0.543  -0.426  -0.164  1.00  0.00           C  
HETATM   16  C   UNL     1       1.419  -1.440   0.208  1.00  0.00           C  
HETATM   17  C   UNL     1       2.780  -1.225   0.168  1.00  0.00           C  
HETATM   18  C   UNL     1       1.035   0.805  -0.583  1.00  0.00           C  
HETATM   19  C   UNL     1       2.394   1.027  -0.625  1.00  0.00           C  
HETATM   20  C   UNL     1       3.278   0.013  -0.247  1.00  0.00           C  
HETATM   21  C   UNL     1       4.733   0.247  -0.290  1.00  0.00           C  
HETATM   22  C   UNL     1       5.268   1.582  -0.738  1.00  0.00           C  
HETATM   23  C   UNL     1       5.542   2.459   0.486  1.00  0.00           C  
HETATM   24  C   UNL     1       5.968   3.855   0.029  1.00  0.00           C  
HETATM   25  N   UNL     1       5.553  -0.697   0.058  1.00  0.00           N  
HETATM   26  N   UNL     1       6.935  -0.508  -0.071  1.00  0.00           N  
HETATM   27  C   UNL     1       7.799  -1.545   0.196  1.00  0.00           C  
HETATM   28  N   UNL     1       7.332  -2.703   0.570  1.00  0.00           N  
HETATM   29  N   UNL     1       9.156  -1.359   0.069  1.00  0.00           N  
HETATM   30  H   UNL     1      -3.311  -1.840  -0.491  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.042  -2.674  -0.758  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.326  -1.822  -0.502  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.827   1.999   0.677  1.00  0.00           H  
HETATM   34  H   UNL     1       7.942  -3.434   0.758  1.00  0.00           H  
HETATM   35  H   UNL     1     -11.001   0.168   0.103  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.958  -0.658  -1.080  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.962  -1.181   0.622  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.877   2.116   0.719  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.191  -1.529  -0.316  1.00  0.00           H  
HETATM   40  H   UNL     1       1.033  -2.396   0.529  1.00  0.00           H  
HETATM   41  H   UNL     1       0.351   1.588  -0.875  1.00  0.00           H  
HETATM   42  H   UNL     1       3.460  -2.012   0.458  1.00  0.00           H  
HETATM   43  H   UNL     1       2.776   1.984  -0.950  1.00  0.00           H  
HETATM   44  H   UNL     1       6.195   1.435  -1.293  1.00  0.00           H  
HETATM   45  H   UNL     1       4.535   2.072  -1.378  1.00  0.00           H  
HETATM   46  H   UNL     1       4.636   2.535   1.088  1.00  0.00           H  
HETATM   47  H   UNL     1       6.338   2.013   1.082  1.00  0.00           H  
HETATM   48  H   UNL     1       5.172   4.301  -0.567  1.00  0.00           H  
HETATM   49  H   UNL     1       6.163   4.479   0.901  1.00  0.00           H  
HETATM   50  H   UNL     1       6.874   3.779  -0.573  1.00  0.00           H  
HETATM   51  H   UNL     1       7.282   0.354  -0.349  1.00  0.00           H  
HETATM   52  H   UNL     1       9.504  -0.497  -0.209  1.00  0.00           H  
HETATM   53  H   UNL     1       9.766  -2.089   0.258  1.00  0.00           H  
CONECT    1    2   11   30                                            
CONECT    2    1    3    9    9                                       
CONECT    3    2    4    4   31                                       
CONECT    4    3    3    5   32                                       
CONECT    5    4    6    8    8                                       
CONECT    6    5    7                                                 
CONECT    7    6   35   36   37                                       
CONECT    8    5    5    9   33                                       
CONECT    9    2    2    8   10                                       
CONECT   10    9   11   11   38                                       
CONECT   11    1   10   10   12                                       
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   39                                            
CONECT   15   14   16   18   18                                       
CONECT   16   15   17   17   40                                       
CONECT   17   16   16   20   42                                       
CONECT   18   15   15   19   41                                       
CONECT   19   18   20   20   43                                       
CONECT   20   17   19   19   21                                       
CONECT   21   20   22   25   25                                       
CONECT   22   21   23   44   45                                       
CONECT   23   22   24   46   47                                       
CONECT   24   23   48   49   50                                       
CONECT   25   21   21   26                                            
CONECT   26   25   27   51                                            
CONECT   27   26   28   28   29                                       
CONECT   28   27   27   34                                            
CONECT   29   27   52   53                                            
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34   28                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38   10                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
