COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.964   1.519  -1.104  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.372  -4.452   0.676  1.00  0.00           C  
HETATM    3  C   UNL     1       1.129  -2.561   1.318  1.00  0.00           C  
HETATM    4  C   UNL     1       1.536   2.348  -0.417  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.939  -1.233   0.825  1.00  0.00           C  
HETATM    6  C   UNL     1       4.823   0.405  -2.109  1.00  0.00           C  
HETATM    7  O   UNL     1      -7.443   1.360  -1.118  1.00  0.00           O  
HETATM    8  O   UNL     1      -6.853   3.142   0.068  1.00  0.00           O  
HETATM    9  N   UNL     1       1.540  -4.004  -0.611  1.00  0.00           N  
HETATM   10  C   UNL     1       1.262  -5.003  -1.427  1.00  0.00           C  
HETATM   11  C   UNL     1       0.138  -5.782  -1.233  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.700  -5.506  -0.163  1.00  0.00           C  
HETATM   13  C   UNL     1       0.766  -3.713   0.416  1.00  0.00           C  
HETATM   14  N   UNL     1       0.415  -1.358   0.884  1.00  0.00           N  
HETATM   15  N   UNL     1       0.292   1.943  -0.292  1.00  0.00           N  
HETATM   16  O   UNL     1       6.056   2.260  -0.873  1.00  0.00           O  
HETATM   17  N   UNL     1       5.868   3.080  -0.005  1.00  0.00           N  
HETATM   18  C   UNL     1       4.067   3.882   1.552  1.00  0.00           C  
HETATM   19  C   UNL     1       4.658   3.019   0.467  1.00  0.00           C  
HETATM   20  C   UNL     1       4.002   1.979  -0.250  1.00  0.00           C  
HETATM   21  C   UNL     1       2.603   1.504  -0.102  1.00  0.00           C  
HETATM   22  C   UNL     1       2.344   0.213   0.354  1.00  0.00           C  
HETATM   23  C   UNL     1       1.018  -0.187   0.476  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.002   0.723   0.143  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.268   0.009   0.382  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.828   0.295  -0.742  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.568  -0.195  -0.553  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.633   0.541   0.179  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.988   1.779   0.720  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.248   2.271   0.534  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.182   1.537  -0.205  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.543   2.067  -0.407  1.00  0.00           C  
HETATM   33  C   UNL     1       0.734  -2.897   2.758  1.00  0.00           C  
HETATM   34  H   UNL     1      -1.002  -4.208   1.519  1.00  0.00           H  
HETATM   35  H   UNL     1       2.204  -2.385   1.268  1.00  0.00           H  
HETATM   36  H   UNL     1       1.736   3.347  -0.775  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.646  -2.005   1.090  1.00  0.00           H  
HETATM   38  H   UNL     1       5.764   0.277  -2.644  1.00  0.00           H  
HETATM   39  H   UNL     1       4.569  -0.521  -1.593  1.00  0.00           H  
HETATM   40  H   UNL     1       4.033   0.654  -2.818  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.322   1.748  -1.224  1.00  0.00           H  
HETATM   42  H   UNL     1       1.919  -5.212  -2.258  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.084  -6.599  -1.904  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.586  -6.098   0.014  1.00  0.00           H  
HETATM   45  H   UNL     1       3.614   4.767   1.105  1.00  0.00           H  
HETATM   46  H   UNL     1       3.305   3.317   2.090  1.00  0.00           H  
HETATM   47  H   UNL     1       4.852   4.185   2.244  1.00  0.00           H  
HETATM   48  H   UNL     1       3.151  -0.461   0.601  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.551  -0.275  -1.308  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.293  -1.153  -0.971  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.265   2.347   1.287  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.522   3.227   0.953  1.00  0.00           H  
HETATM   53  H   UNL     1       0.996  -2.064   3.410  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.340  -3.073   2.808  1.00  0.00           H  
HETATM   55  H   UNL     1       1.265  -3.792   3.081  1.00  0.00           H  
CONECT    1   20   20   16    6                                       
CONECT    2   12   12   13   34                                       
CONECT    3   33   13   14   35                                       
CONECT    4   21   21   15   36                                       
CONECT    5   14   25   25   37                                       
CONECT    6    1   38   39   40                                       
CONECT    7   32   41                                                 
CONECT    8   32   32                                                 
CONECT    9   10   13   13                                            
CONECT   10   11   11    9   42                                       
CONECT   11   10   10   12   43                                       
CONECT   12   11    2    2   44                                       
CONECT   13    9    9    2    3                                       
CONECT   14    3    5   23                                            
CONECT   15   24   24    4                                            
CONECT   16   17    1                                                 
CONECT   17   19   19   16                                            
CONECT   18   19   45   46   47                                       
CONECT   19   18   17   17   20                                       
CONECT   20   19   21    1    1                                       
CONECT   21   22   20    4    4                                       
CONECT   22   23   23   21   48                                       
CONECT   23   14   22   22   24                                       
CONECT   24   23   25   15   15                                       
CONECT   25    5    5   24   28                                       
CONECT   26   27   27   31   49                                       
CONECT   27   28   26   26   50                                       
CONECT   28   25   29   29   27                                       
CONECT   29   28   28   30   51                                       
CONECT   30   29   31   31   52                                       
CONECT   31   30   30   26   32                                       
CONECT   32   31    8    8    7                                       
CONECT   33    3   53   54   55                                       
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   22                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   33                                                      
CONECT   54   33                                                      
CONECT   55   33                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
