COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.287  -3.489   0.975  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.181  -3.432  -0.084  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.674  -2.209  -0.506  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.264  -1.034   0.143  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.363  -1.109   1.209  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.884  -2.321   1.616  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.809  -4.689   1.393  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.548  -2.147  -1.542  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.781   0.273  -0.298  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.959   0.399  -0.574  1.00  0.00           O  
HETATM   11  N   UNL     1      -2.950   1.328  -0.395  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.481   2.680  -0.617  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.748   3.634   0.335  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.263   3.649  -0.030  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.982   2.702  -0.317  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.566   1.156  -0.280  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.725   2.245  -0.108  1.00  0.00           C  
HETATM   18  C   UNL     1       0.639   2.047   0.001  1.00  0.00           C  
HETATM   19  C   UNL     1       1.168   0.760  -0.069  1.00  0.00           C  
HETATM   20  C   UNL     1       0.320  -0.332  -0.251  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.038  -0.131  -0.353  1.00  0.00           C  
HETATM   22  C   UNL     1       2.631   0.552   0.048  1.00  0.00           C  
HETATM   23  N   UNL     1       3.235  -0.268  -0.791  1.00  0.00           N  
HETATM   24  C   UNL     1       4.690   1.059   1.161  1.00  0.00           C  
HETATM   25  C   UNL     1       3.343   1.237   1.046  1.00  0.00           C  
HETATM   26  C   UNL     1       5.325   0.173   0.268  1.00  0.00           C  
HETATM   27  C   UNL     1       4.551  -0.485  -0.721  1.00  0.00           C  
HETATM   28  C   UNL     1       5.187  -1.368  -1.611  1.00  0.00           C  
HETATM   29  C   UNL     1       6.528  -1.579  -1.511  1.00  0.00           C  
HETATM   30  C   UNL     1       7.287  -0.931  -0.538  1.00  0.00           C  
HETATM   31  C   UNL     1       6.706  -0.068   0.341  1.00  0.00           C  
HETATM   32  C   UNL     1       2.621   2.167   1.986  1.00  0.00           C  
HETATM   33  H   UNL     1      -3.492  -4.341  -0.578  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.045  -0.207   1.711  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.188  -2.374   2.440  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.996  -4.964   0.948  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.476  -2.206  -1.277  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.307   2.980  -1.650  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.159   4.638   0.233  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.870   3.291   1.362  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.140   4.136  -0.998  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.709   4.206   0.725  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.165   2.240   0.653  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.334   3.733  -0.302  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.515   2.147  -1.090  1.00  0.00           H  
HETATM   46  H   UNL     1       1.296   2.893   0.142  1.00  0.00           H  
HETATM   47  H   UNL     1       0.726  -1.331  -0.308  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.695  -0.975  -0.498  1.00  0.00           H  
HETATM   49  H   UNL     1       5.253   1.574   1.924  1.00  0.00           H  
HETATM   50  H   UNL     1       4.614  -1.879  -2.371  1.00  0.00           H  
HETATM   51  H   UNL     1       7.012  -2.258  -2.197  1.00  0.00           H  
HETATM   52  H   UNL     1       8.349  -1.115  -0.481  1.00  0.00           H  
HETATM   53  H   UNL     1       7.305   0.428   1.091  1.00  0.00           H  
HETATM   54  H   UNL     1       2.535   3.152   1.528  1.00  0.00           H  
HETATM   55  H   UNL     1       1.626   1.774   2.193  1.00  0.00           H  
HETATM   56  H   UNL     1       3.181   2.247   2.918  1.00  0.00           H  
CONECT    1    6    7    2    2                                       
CONECT    2    1    1    3   33                                       
CONECT    3    4    4    2    8                                       
CONECT    4    5    9    3    3                                       
CONECT    5    6    6    4   34                                       
CONECT    6    5    5    1   35                                       
CONECT    7    1   36                                                 
CONECT    8    3   37                                                 
CONECT    9   11    4   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   16   12    9                                            
CONECT   12   13   11   15   38                                       
CONECT   13   14   12   39   40                                       
CONECT   14   17   13   41   42                                       
CONECT   15   12   43   44   45                                       
CONECT   16   17   17   11   21                                       
CONECT   17   14   18   16   16                                       
CONECT   18   19   19   17   46                                       
CONECT   19   22   18   18   20                                       
CONECT   20   19   21   21   47                                       
CONECT   21   20   20   16   48                                       
CONECT   22   25   25   23   19                                       
CONECT   23   27   27   22                                            
CONECT   24   26   26   25   49                                       
CONECT   25   24   32   22   22                                       
CONECT   26   31   24   24   27                                       
CONECT   27   26   28   23   23                                       
CONECT   28   29   29   27   50                                       
CONECT   29   30   28   28   51                                       
CONECT   30   31   31   29   52                                       
CONECT   31   30   30   26   53                                       
CONECT   32   25   54   55   56                                       
CONECT   33    2                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   24                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
