COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.129  -2.416  -1.757  1.00  0.00           C  
HETATM    2  O   UNL     1       3.270  -1.493  -1.085  1.00  0.00           O  
HETATM    3  C   UNL     1       2.336  -2.270  -0.333  1.00  0.00           C  
HETATM    4  C   UNL     1       1.096  -2.515  -1.202  1.00  0.00           C  
HETATM    5  N   UNL     1       0.514  -1.230  -1.612  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.242  -1.483  -2.846  1.00  0.00           C  
HETATM    7  C   UNL     1       0.082  -3.299  -0.360  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.244  -2.514   0.901  1.00  0.00           C  
HETATM    9  O   UNL     1       0.885  -2.113   1.627  1.00  0.00           O  
HETATM   10  C   UNL     1       1.915  -1.497   0.910  1.00  0.00           C  
HETATM   11  C   UNL     1       3.140  -1.537   1.825  1.00  0.00           C  
HETATM   12  N   UNL     1       1.689  -0.084   0.618  1.00  0.00           N  
HETATM   13  C   UNL     1       2.638   0.906   0.517  1.00  0.00           C  
HETATM   14  C   UNL     1       4.025   0.847   0.639  1.00  0.00           C  
HETATM   15  C   UNL     1       4.724   2.034   0.490  1.00  0.00           C  
HETATM   16  C   UNL     1       4.089   3.235   0.230  1.00  0.00           C  
HETATM   17  C   UNL     1       2.712   3.320   0.103  1.00  0.00           C  
HETATM   18  C   UNL     1       1.992   2.135   0.250  1.00  0.00           C  
HETATM   19  C   UNL     1       0.557   1.852   0.177  1.00  0.00           C  
HETATM   20  C   UNL     1       0.437   0.476   0.412  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.816  -0.138   0.408  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.164  -1.418   0.622  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.533  -1.542   0.481  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.374  -2.790   0.613  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.832  -2.374   0.840  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.241  -1.350  -0.222  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.513  -0.027   0.041  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.043  -0.315   0.226  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.975   0.604   0.168  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.848   2.039  -0.071  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.581   2.619  -0.059  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.785   4.088  -0.338  1.00  0.00           C  
HETATM   33  N   UNL     1      -2.231   4.277  -0.501  1.00  0.00           N  
HETATM   34  C   UNL     1      -2.837   3.088  -0.344  1.00  0.00           C  
HETATM   35  O   UNL     1      -4.038   2.907  -0.419  1.00  0.00           O  
HETATM   36  H   UNL     1       4.862  -1.867  -2.347  1.00  0.00           H  
HETATM   37  H   UNL     1       4.644  -3.035  -1.022  1.00  0.00           H  
HETATM   38  H   UNL     1       3.536  -3.052  -2.415  1.00  0.00           H  
HETATM   39  H   UNL     1       2.801  -3.210  -0.036  1.00  0.00           H  
HETATM   40  H   UNL     1       1.371  -3.094  -2.083  1.00  0.00           H  
HETATM   41  H   UNL     1       1.286  -0.629  -1.863  1.00  0.00           H  
HETATM   42  H   UNL     1       0.431  -1.867  -3.612  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.023  -2.217  -2.648  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.695  -0.554  -3.191  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.829  -3.452  -0.939  1.00  0.00           H  
HETATM   46  H   UNL     1       0.506  -4.266  -0.088  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.788  -3.202   1.548  1.00  0.00           H  
HETATM   48  H   UNL     1       3.145  -2.473   2.384  1.00  0.00           H  
HETATM   49  H   UNL     1       4.046  -1.468   1.223  1.00  0.00           H  
HETATM   50  H   UNL     1       3.102  -0.699   2.521  1.00  0.00           H  
HETATM   51  H   UNL     1       4.534  -0.084   0.842  1.00  0.00           H  
HETATM   52  H   UNL     1       5.800   2.021   0.579  1.00  0.00           H  
HETATM   53  H   UNL     1       4.682   4.131   0.124  1.00  0.00           H  
HETATM   54  H   UNL     1       2.219   4.259  -0.100  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.025  -3.379   1.460  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.300  -3.379  -0.301  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.933  -1.931   1.831  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.475  -3.251   0.767  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.318  -1.188  -0.175  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.971  -1.724  -1.210  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.911   0.437   0.943  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.651   0.641  -0.809  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.422   4.682   0.501  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.264   4.372  -1.252  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.674   5.119  -0.690  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    1    3                                                 
CONECT    3    2    4   10   39                                       
CONECT    4    3    5    7   40                                       
CONECT    5    4    6   41                                            
CONECT    6    5   42   43   44                                       
CONECT    7    4    8   45   46                                       
CONECT    8    7    9   22   47                                       
CONECT    9    8   10                                                 
CONECT   10    3    9   11   12                                       
CONECT   11   10   48   49   50                                       
CONECT   12   10   13   20                                            
CONECT   13   12   14   14   18                                       
CONECT   14   13   13   15   51                                       
CONECT   15   14   16   16   52                                       
CONECT   16   15   15   17   53                                       
CONECT   17   16   18   18   54                                       
CONECT   18   13   17   17   19                                       
CONECT   19   18   20   20   31                                       
CONECT   20   12   19   19   21                                       
CONECT   21   20   22   29   29                                       
CONECT   22    8   21   23                                            
CONECT   23   22   24   28   28                                       
CONECT   24   23   25   55   56                                       
CONECT   25   24   26   57   58                                       
CONECT   26   25   27   59   60                                       
CONECT   27   26   28   61   62                                       
CONECT   28   23   23   27   29                                       
CONECT   29   21   21   28   30                                       
CONECT   30   29   31   31   34                                       
CONECT   31   19   30   30   32                                       
CONECT   32   31   33   63   64                                       
CONECT   33   32   34   65                                            
CONECT   34   30   33   35   35                                       
CONECT   35   34   34                                                 
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
