COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.783   4.350  -0.316  1.00  0.00           C  
HETATM    2  C   UNL     1       5.416   4.242   0.309  1.00  0.00           C  
HETATM    3  C   UNL     1       3.312   2.721   0.515  1.00  0.00           C  
HETATM    4  N   UNL     1       3.494  -5.540   1.172  1.00  0.00           N  
HETATM    5  C   UNL     1       2.565  -1.611  -0.054  1.00  0.00           C  
HETATM    6  C   UNL     1       1.298  -1.145  -0.487  1.00  0.00           C  
HETATM    7  C   UNL     1       0.058  -1.953  -0.589  1.00  0.00           C  
HETATM    8  C   UNL     1       0.126  -3.294  -0.965  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.029  -4.044  -1.060  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.255  -3.470  -0.782  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.333  -2.135  -0.406  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.177  -1.376  -0.303  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.796  -0.259  -0.414  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.062   0.379  -0.014  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.438   3.082   0.293  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.802   3.053  -0.401  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.721   3.108   1.126  1.00  0.00           C  
HETATM   18  C   UNL     1       2.892  -2.992   0.377  1.00  0.00           C  
HETATM   19  C   UNL     1       4.263  -4.951   0.276  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.949   0.385  -1.003  1.00  0.00           O  
HETATM   21  N   UNL     1      -6.086  -0.216   0.649  1.00  0.00           N  
HETATM   22  C   UNL     1      -7.034   0.656   0.834  1.00  0.00           C  
HETATM   23  N   UNL     1      -6.655   1.844   0.296  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.416   1.677  -0.239  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.576  -1.558  -0.126  1.00  0.00           N  
HETATM   26  C   UNL     1       2.105  -3.653   1.325  1.00  0.00           C  
HETATM   27  C   UNL     1       2.444  -4.937   1.697  1.00  0.00           C  
HETATM   28  C   UNL     1       3.995  -3.668  -0.153  1.00  0.00           C  
HETATM   29  C   UNL     1       3.430  -0.559  -0.113  1.00  0.00           C  
HETATM   30  N   UNL     1       1.418   0.130  -0.781  1.00  0.00           N  
HETATM   31  N   UNL     1       2.744   0.515  -0.554  1.00  0.00           N  
HETATM   32  C   UNL     1       3.295   1.857  -0.759  1.00  0.00           C  
HETATM   33  C   UNL     1       4.832   1.913  -0.698  1.00  0.00           C  
HETATM   34  N   UNL     1       4.656   3.153   0.082  1.00  0.00           N  
HETATM   35  O   UNL     1       5.001   5.135   1.016  1.00  0.00           O  
HETATM   36  C   UNL     1       7.430   5.673   0.098  1.00  0.00           C  
HETATM   37  H   UNL     1       7.404   3.520   0.022  1.00  0.00           H  
HETATM   38  H   UNL     1       6.690   4.315  -1.402  1.00  0.00           H  
HETATM   39  H   UNL     1       2.572   3.521   0.513  1.00  0.00           H  
HETATM   40  H   UNL     1       3.311   2.142   1.438  1.00  0.00           H  
HETATM   41  H   UNL     1       1.082  -3.745  -1.183  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.974  -5.082  -1.352  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.156  -4.061  -0.858  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.234  -0.339  -0.007  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.861   4.004   0.229  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.121   3.956  -0.921  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.116   2.113  -0.855  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.982   2.204   1.676  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.988   4.047   1.611  1.00  0.00           H  
HETATM   50  H   UNL     1       5.112  -5.481  -0.128  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.972   0.466   1.335  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.825   2.429  -0.741  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.279  -2.092   0.275  1.00  0.00           H  
HETATM   54  H   UNL     1       1.244  -3.166   1.758  1.00  0.00           H  
HETATM   55  H   UNL     1       1.842  -5.456   2.428  1.00  0.00           H  
HETATM   56  H   UNL     1       4.629  -3.192  -0.886  1.00  0.00           H  
HETATM   57  H   UNL     1       4.478  -0.581   0.148  1.00  0.00           H  
HETATM   58  H   UNL     1       2.871   2.363  -1.627  1.00  0.00           H  
HETATM   59  H   UNL     1       5.279   1.096  -0.131  1.00  0.00           H  
HETATM   60  H   UNL     1       5.305   2.065  -1.668  1.00  0.00           H  
HETATM   61  H   UNL     1       8.419   5.751  -0.354  1.00  0.00           H  
HETATM   62  H   UNL     1       6.809   6.503  -0.240  1.00  0.00           H  
HETATM   63  H   UNL     1       7.523   5.708   1.183  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    1   34   35   35                                       
CONECT    3   34   32   39   40                                       
CONECT    4   19   19   27                                            
CONECT    5   29   29    6   18                                       
CONECT    6   30   30    7    5                                       
CONECT    7    6   12   12    8                                       
CONECT    8    7    9    9   41                                       
CONECT    9    8    8   10   42                                       
CONECT   10   11   11    9   43                                       
CONECT   11   25   12   10   10                                       
CONECT   12    7    7   11   44                                       
CONECT   13   14   25   20   20                                       
CONECT   14   21   24   24   13                                       
CONECT   15   17   16   23   45                                       
CONECT   16   17   15   46   47                                       
CONECT   17   15   16   48   49                                       
CONECT   18    5   28   28   26                                       
CONECT   19   28    4    4   50                                       
CONECT   20   13   13                                                 
CONECT   21   22   22   14                                            
CONECT   22   21   21   23   51                                       
CONECT   23   22   15   24                                            
CONECT   24   23   14   14   52                                       
CONECT   25   13   11   53                                            
CONECT   26   18   27   27   54                                       
CONECT   27   26   26    4   55                                       
CONECT   28   18   18   19   56                                       
CONECT   29   31    5    5   57                                       
CONECT   30   31    6    6                                            
CONECT   31   32   30   29                                            
CONECT   32    3   33   31   58                                       
CONECT   33   34   32   59   60                                       
CONECT   34    2    3   33                                            
CONECT   35    2    2                                                 
CONECT   36    1   61   62   63                                       
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   36                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
