COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1      -8.442  -0.202   1.371  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.862  -0.265   0.303  1.00  0.00           C  
HETATM    3  N   UNL     1      -8.285  -1.127  -0.643  1.00  0.00           N  
HETATM    4  C   UNL     1      -9.442  -1.987  -0.387  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.703   0.603   0.043  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.284   0.304   0.323  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.613  -0.784   0.873  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.574   1.436  -0.101  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.468   2.322  -0.585  1.00  0.00           O  
HETATM   10  C   UNL     1      -6.716   1.845  -0.511  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.951   2.576  -0.971  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.191   1.461   0.033  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.531   0.375   0.581  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.242  -0.746   1.000  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.179   0.404   0.711  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.448  -0.442  -0.057  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.048  -1.217  -1.034  1.00  0.00           C  
HETATM   18  C   UNL     1       0.951  -0.555   0.113  1.00  0.00           C  
HETATM   19  C   UNL     1       1.629   0.202   1.080  1.00  0.00           C  
HETATM   20  C   UNL     1       1.670  -1.452  -0.713  1.00  0.00           C  
HETATM   21  N   UNL     1       1.024  -2.175  -1.636  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.273  -2.074  -1.805  1.00  0.00           C  
HETATM   23  C   UNL     1       3.060  -1.568  -0.549  1.00  0.00           C  
HETATM   24  C   UNL     1       3.697  -0.812   0.408  1.00  0.00           C  
HETATM   25  C   UNL     1       2.976   0.070   1.220  1.00  0.00           C  
HETATM   26  O   UNL     1       5.041  -0.924   0.568  1.00  0.00           O  
HETATM   27  C   UNL     1       5.645  -0.113   1.577  1.00  0.00           C  
HETATM   28  C   UNL     1       7.152  -0.375   1.608  1.00  0.00           C  
HETATM   29  N   UNL     1       7.752   0.069   0.343  1.00  0.00           N  
HETATM   30  C   UNL     1       9.149  -0.378   0.236  1.00  0.00           C  
HETATM   31  C   UNL     1       7.660   1.529   0.200  1.00  0.00           C  
HETATM   32  C   UNL     1       8.242   1.941  -1.155  1.00  0.00           C  
HETATM   33  O   UNL     1       9.589   1.472  -1.253  1.00  0.00           O  
HETATM   34  C   UNL     1       9.715   0.053  -1.119  1.00  0.00           C  
HETATM   35  H   UNL     1      -7.822  -1.177  -1.495  1.00  0.00           H  
HETATM   36  H   UNL     1     -10.317  -1.369  -0.184  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.632  -2.611  -1.260  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.239  -2.622   0.476  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.164  -1.653   1.199  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.717  -1.588   1.427  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.632   2.326  -0.290  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.351   3.167  -0.147  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.696   3.234  -1.801  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.701   1.854  -1.296  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.114  -1.155  -1.196  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.752  -2.674  -2.565  1.00  0.00           H  
HETATM   47  H   UNL     1       1.084   0.887   1.712  1.00  0.00           H  
HETATM   48  H   UNL     1       3.495   0.654   1.965  1.00  0.00           H  
HETATM   49  H   UNL     1       3.625  -2.247  -1.169  1.00  0.00           H  
HETATM   50  H   UNL     1       5.463   0.938   1.356  1.00  0.00           H  
HETATM   51  H   UNL     1       5.214  -0.360   2.548  1.00  0.00           H  
HETATM   52  H   UNL     1       7.600   0.175   2.435  1.00  0.00           H  
HETATM   53  H   UNL     1       7.333  -1.442   1.741  1.00  0.00           H  
HETATM   54  H   UNL     1       9.737   0.071   1.037  1.00  0.00           H  
HETATM   55  H   UNL     1       9.191  -1.464   0.319  1.00  0.00           H  
HETATM   56  H   UNL     1       6.616   1.835   0.256  1.00  0.00           H  
HETATM   57  H   UNL     1       8.224   2.009   1.000  1.00  0.00           H  
HETATM   58  H   UNL     1      10.767  -0.226  -1.179  1.00  0.00           H  
HETATM   59  H   UNL     1       9.161  -0.439  -1.918  1.00  0.00           H  
HETATM   60  H   UNL     1       7.645   1.505  -1.955  1.00  0.00           H  
HETATM   61  H   UNL     1       8.228   3.028  -1.241  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4   35                                            
CONECT    4    3   36   37   38                                       
CONECT    5    2    6   10   10                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   14   14   39                                       
CONECT    8    6    6    9   12                                       
CONECT    9    8   10                                                 
CONECT   10    5    5    9   11                                       
CONECT   11   10   42   43   44                                       
CONECT   12    8   13   13   41                                       
CONECT   13   12   12   14   15                                       
CONECT   14    7    7   13   40                                       
CONECT   15   13   16                                                 
CONECT   16   15   17   17   18                                       
CONECT   17   16   16   22   45                                       
CONECT   18   16   19   20   20                                       
CONECT   19   18   25   25   47                                       
CONECT   20   18   18   21   23                                       
CONECT   21   20   22   22                                            
CONECT   22   17   21   21   46                                       
CONECT   23   20   24   24   49                                       
CONECT   24   23   23   25   26                                       
CONECT   25   19   19   24   48                                       
CONECT   26   24   27                                                 
CONECT   27   26   28   50   51                                       
CONECT   28   27   29   52   53                                       
CONECT   29   28   30   31                                            
CONECT   30   29   34   54   55                                       
CONECT   31   29   32   56   57                                       
CONECT   32   31   33   60   61                                       
CONECT   33   32   34                                                 
CONECT   34   30   33   58   59                                       
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40   14                                                      
CONECT   41   12                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   17                                                      
CONECT   46   22                                                      
CONECT   47   19                                                      
CONECT   48   25                                                      
CONECT   49   23                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
