COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.223   1.664  -1.355  1.00  0.00           C  
HETATM    2  N   UNL     1       7.910   0.678  -0.803  1.00  0.00           N  
HETATM    3  C   UNL     1       7.324  -0.363  -0.243  1.00  0.00           C  
HETATM    4  N   UNL     1       5.036  -1.370   0.277  1.00  0.00           N  
HETATM    5  C   UNL     1       5.857   1.661  -1.371  1.00  0.00           C  
HETATM    6  N   UNL     1       3.881   0.261  -0.627  1.00  0.00           N  
HETATM    7  C   UNL     1       3.785  -0.885   0.006  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.969  -0.557   0.238  1.00  0.00           N  
HETATM    9  C   UNL     1       5.177   0.584  -0.787  1.00  0.00           C  
HETATM   10  N   UNL     1      -6.374  -0.584  -2.225  1.00  0.00           N  
HETATM   11  C   UNL     1       5.942  -0.455  -0.217  1.00  0.00           C  
HETATM   12  N   UNL     1      -7.775   0.566  -0.536  1.00  0.00           N  
HETATM   13  C   UNL     1       2.518  -1.557   0.360  1.00  0.00           C  
HETATM   14  C   UNL     1       0.139  -2.825   1.024  1.00  0.00           C  
HETATM   15  C   UNL     1       1.274  -3.573   0.762  1.00  0.00           C  
HETATM   16  C   UNL     1       2.459  -2.948   0.432  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.200  -0.099   0.541  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.308  -0.266  -0.422  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.399   0.452   1.606  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.107  -0.896  -1.653  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.173  -1.032  -2.524  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.871  -0.391   1.193  1.00  0.00           C  
HETATM   23  C   UNL     1       0.182  -1.447   0.963  1.00  0.00           C  
HETATM   24  C   UNL     1       1.365  -0.795   0.632  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.185   0.935   0.971  1.00  0.00           C  
HETATM   26  C   UNL     1       1.141   0.670   0.637  1.00  0.00           C  
HETATM   27  C   UNL     1       2.007   1.734   0.374  1.00  0.00           C  
HETATM   28  C   UNL     1       1.545   3.032   0.447  1.00  0.00           C  
HETATM   29  C   UNL     1       0.226   3.285   0.780  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.637   2.235   1.042  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.604   0.202  -0.130  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.633   0.021  -1.077  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.506   1.078   0.703  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.209   0.889   1.006  1.00  0.00           C  
HETATM   35  H   UNL     1       7.753   2.493  -1.798  1.00  0.00           H  
HETATM   36  H   UNL     1       7.924  -1.146   0.196  1.00  0.00           H  
HETATM   37  H   UNL     1       5.311   2.474  -1.825  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.811  -0.996  -0.612  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.785  -3.322   1.282  1.00  0.00           H  
HETATM   40  H   UNL     1       1.232  -4.651   0.813  1.00  0.00           H  
HETATM   41  H   UNL     1       3.341  -3.536   0.229  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.131  -1.271  -1.921  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.016  -1.519  -3.475  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.248  -0.452   2.213  1.00  0.00           H  
HETATM   45  H   UNL     1       3.037   1.541   0.113  1.00  0.00           H  
HETATM   46  H   UNL     1       2.215   3.853   0.243  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.130   4.303   0.836  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.666   2.435   1.301  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.229   1.563   1.343  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.711   1.188   1.916  1.00  0.00           H  
HETATM   51  H   UNL     1       5.246  -2.201   0.731  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.642   0.585  -0.970  1.00  0.00           H  
CONECT    1    5    5    2   35                                       
CONECT    2    1    3    3                                            
CONECT    3    2    2   11   36                                       
CONECT    4    7   11   51                                            
CONECT    5    1    1    9   37                                       
CONECT    6    9    7    7                                            
CONECT    7    4    6    6   13                                       
CONECT    8   17   22   38                                            
CONECT    9    5    6   11   11                                       
CONECT   10   32   32   21                                            
CONECT   11    3    4    9    9                                       
CONECT   12   33   32   52                                            
CONECT   13    7   24   24   16                                       
CONECT   14   23   23   15   39                                       
CONECT   15   14   16   16   40                                       
CONECT   16   13   15   15   41                                       
CONECT   17    8   19   19   18                                       
CONECT   18   17   31   31   20                                       
CONECT   19   17   17                                                 
CONECT   20   18   21   21   42                                       
CONECT   21   10   20   20   43                                       
CONECT   22    8   25   23   44                                       
CONECT   23   14   14   22   24                                       
CONECT   24   13   13   23   26                                       
CONECT   25   22   30   30   26                                       
CONECT   26   24   25   27   27                                       
CONECT   27   26   26   28   45                                       
CONECT   28   27   29   29   46                                       
CONECT   29   28   28   30   47                                       
CONECT   30   25   25   29   48                                       
CONECT   31   18   18   34   32                                       
CONECT   32   10   10   12   31                                       
CONECT   33   12   34   34   49                                       
CONECT   34   31   33   33   50                                       
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   33                                                      
CONECT   50   34                                                      
CONECT   51    4                                                      
CONECT   52   12                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
