COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.568  -3.330  -2.260  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.437   2.537  -2.090  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.746   1.297  -1.518  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.708   1.719  -0.511  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.538   2.895  -0.273  1.00  0.00           O  
HETATM    6  N   UNL     1      -3.970   0.788   0.126  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.057  -0.544  -0.050  1.00  0.00           C  
HETATM    8  O   UNL     1      -4.821  -1.100  -0.816  1.00  0.00           O  
HETATM    9  N   UNL     1      -3.171  -1.166   0.749  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.968  -2.614   0.840  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.905  -3.045  -0.172  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.648  -2.464   0.181  1.00  0.00           O  
HETATM   13  C   UNL     1       0.411  -2.749  -0.623  1.00  0.00           C  
HETATM   14  C   UNL     1       0.247  -3.578  -1.721  1.00  0.00           C  
HETATM   15  C   UNL     1       1.323  -3.862  -2.540  1.00  0.00           C  
HETATM   16  C   UNL     1       2.742  -2.511  -1.160  1.00  0.00           C  
HETATM   17  C   UNL     1       1.666  -2.218  -0.338  1.00  0.00           C  
HETATM   18  O   UNL     1       1.833  -1.404   0.738  1.00  0.00           O  
HETATM   19  C   UNL     1       3.043  -0.813   0.909  1.00  0.00           C  
HETATM   20  C   UNL     1       3.995  -1.400   1.712  1.00  0.00           C  
HETATM   21  C   UNL     1       5.240  -0.803   1.895  1.00  0.00           C  
HETATM   22  C   UNL     1       5.550   0.374   1.286  1.00  0.00           C  
HETATM   23  C   UNL     1       4.605   1.006   0.458  1.00  0.00           C  
HETATM   24  C   UNL     1       4.900   2.220  -0.181  1.00  0.00           C  
HETATM   25  C   UNL     1       3.945   2.814  -0.990  1.00  0.00           C  
HETATM   26  C   UNL     1       4.240   4.053  -1.645  1.00  0.00           C  
HETATM   27  N   UNL     1       4.473   5.036  -2.164  1.00  0.00           N  
HETATM   28  C   UNL     1       2.689   2.209  -1.173  1.00  0.00           C  
HETATM   29  C   UNL     1       2.387   1.034  -0.562  1.00  0.00           C  
HETATM   30  C   UNL     1       3.337   0.404   0.260  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.479  -0.199   1.476  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.474  -0.264   2.429  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.977   0.899   2.985  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.479   2.129   2.594  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.480   2.203   1.645  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.980   1.041   1.078  1.00  0.00           C  
HETATM   37  H   UNL     1       3.408  -3.558  -2.900  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.917   3.090  -1.282  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.696   3.174  -2.575  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.486   0.660  -1.033  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.638  -2.872   1.846  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.905  -3.126   0.623  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.818  -4.131  -0.168  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.194  -2.708  -1.168  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.724  -3.999  -1.939  1.00  0.00           H  
HETATM   46  H   UNL     1       1.192  -4.501  -3.401  1.00  0.00           H  
HETATM   47  H   UNL     1       3.717  -2.101  -0.942  1.00  0.00           H  
HETATM   48  H   UNL     1       3.773  -2.334   2.207  1.00  0.00           H  
HETATM   49  H   UNL     1       5.970  -1.282   2.530  1.00  0.00           H  
HETATM   50  H   UNL     1       6.520   0.822   1.440  1.00  0.00           H  
HETATM   51  H   UNL     1       5.864   2.688  -0.042  1.00  0.00           H  
HETATM   52  H   UNL     1       1.955   2.684  -1.807  1.00  0.00           H  
HETATM   53  H   UNL     1       1.418   0.581  -0.712  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.080  -1.222   2.737  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.194   0.849   3.727  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.087   3.034   3.033  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.870   3.163   1.344  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.187   2.232  -2.819  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.266   0.744  -2.326  1.00  0.00           H  
CONECT    1   15   16   16   37                                       
CONECT    2    3   38   39   58                                       
CONECT    3    2    4   40   59                                       
CONECT    4    3    6    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    7    4   36                                            
CONECT    7    8    8    9    6                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   31                                            
CONECT   10   11    9   41   42                                       
CONECT   11   12   10   43   44                                       
CONECT   12   11   13                                                 
CONECT   13   14   12   17   17                                       
CONECT   14   15   15   13   45                                       
CONECT   15   14   14    1   46                                       
CONECT   16    1    1   17   47                                       
CONECT   17   13   13   16   18                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   20   30                                       
CONECT   20   19   19   21   48                                       
CONECT   21   20   22   22   49                                       
CONECT   22   21   21   23   50                                       
CONECT   23   30   22   24   24                                       
CONECT   24   23   23   25   51                                       
CONECT   25   28   28   24   26                                       
CONECT   26   25   27   27   27                                       
CONECT   27   26   26   26                                            
CONECT   28   29   25   25   52                                       
CONECT   29   30   30   28   53                                       
CONECT   30   19   29   29   23                                       
CONECT   31    9   36   36   32                                       
CONECT   32   31   33   33   54                                       
CONECT   33   32   32   34   55                                       
CONECT   34   35   35   33   56                                       
CONECT   35   36   34   34   57                                       
CONECT   36    6   31   31   35                                       
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   32                                                      
CONECT   55   33                                                      
CONECT   56   34                                                      
CONECT   57   35                                                      
CONECT   58    2                                                      
CONECT   59    3                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
