COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.776   2.253   0.058  1.00  0.00           N  
HETATM    2  N   UNL     1       1.043  -4.610  -0.778  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.900   2.042  -0.114  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.982   1.083   0.192  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.263   0.426   0.052  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.570   0.834   0.283  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.565  -0.111   0.475  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.253  -1.463   0.436  1.00  0.00           C  
HETATM    9  C   UNL     1       0.431   1.694   0.120  1.00  0.00           C  
HETATM   10  C   UNL     1       3.153   0.924   0.086  1.00  0.00           C  
HETATM   11  C   UNL     1       1.638  -2.341  -0.572  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.156  -4.284  -1.221  1.00  0.00           C  
HETATM   13  C   UNL     1       1.936  -3.697  -0.454  1.00  0.00           C  
HETATM   14  C   UNL     1       4.792  -0.817   0.468  1.00  0.00           C  
HETATM   15  C   UNL     1       5.616   1.260   0.853  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.256   1.377  -0.137  1.00  0.00           N  
HETATM   17  C   UNL     1       2.226   4.824  -1.020  1.00  0.00           C  
HETATM   18  O   UNL     1      -7.845   0.285   0.702  1.00  0.00           O  
HETATM   19  C   UNL     1       1.126   3.843  -0.705  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.952  -1.868   0.206  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.958  -0.929   0.014  1.00  0.00           C  
HETATM   22  C   UNL     1       1.441   2.597  -0.176  1.00  0.00           C  
HETATM   23  C   UNL     1       2.645  -1.314  -0.207  1.00  0.00           C  
HETATM   24  C   UNL     1       0.376  -1.964  -1.039  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.527  -2.960  -1.366  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.193   4.190  -0.932  1.00  0.00           C  
HETATM   27  C   UNL     1       4.461   0.553   0.457  1.00  0.00           C  
HETATM   28  C   UNL     1       6.873  -2.132   1.006  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.205   3.297  -0.646  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.818  -0.743   0.892  1.00  0.00           C  
HETATM   31  N   UNL     1       2.290  -0.033  -0.232  1.00  0.00           N  
HETATM   32  N   UNL     1       3.862  -1.707   0.129  1.00  0.00           N  
HETATM   33  N   UNL     1       6.568   0.400   1.085  1.00  0.00           N  
HETATM   34  N   UNL     1       6.098  -0.898   0.853  1.00  0.00           N  
HETATM   35  O   UNL     1      -1.723   0.030   0.742  1.00  0.00           O  
HETATM   36  H   UNL     1       3.437   2.948   0.204  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.810   1.887   0.314  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.029  -2.200   0.586  1.00  0.00           H  
HETATM   39  H   UNL     1       0.673   0.725   0.531  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.858  -5.064  -1.476  1.00  0.00           H  
HETATM   41  H   UNL     1       2.908  -4.003  -0.094  1.00  0.00           H  
HETATM   42  H   UNL     1       5.698   2.332   0.947  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.473   2.247  -0.504  1.00  0.00           H  
HETATM   44  H   UNL     1       2.426   5.440  -0.142  1.00  0.00           H  
HETATM   45  H   UNL     1       3.129   4.281  -1.296  1.00  0.00           H  
HETATM   46  H   UNL     1       1.917   5.462  -1.848  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.713  -2.921   0.177  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.942  -1.248  -0.166  1.00  0.00           H  
HETATM   49  H   UNL     1       0.112  -0.921  -1.142  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.512  -2.706  -1.730  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.431   5.163  -1.335  1.00  0.00           H  
HETATM   52  H   UNL     1       6.766  -2.505   2.024  1.00  0.00           H  
HETATM   53  H   UNL     1       6.506  -2.881   0.304  1.00  0.00           H  
HETATM   54  H   UNL     1       7.924  -1.928   0.802  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.233   3.568  -0.832  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.795  -0.291   1.063  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.860  -1.372   0.003  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.543  -1.350   1.754  1.00  0.00           H  
CONECT    1   10   22   36                                            
CONECT    2   13   13   12                                            
CONECT    3    9    9   29    4                                       
CONECT    4    3   35   35   16                                       
CONECT    5    6   16   21   21                                       
CONECT    6    7    7    5   37                                       
CONECT    7   18    6    6    8                                       
CONECT    8    7   20   20   38                                       
CONECT    9   22    3    3   39                                       
CONECT   10   27    1   31   31                                       
CONECT   11   23   24   24   13                                       
CONECT   12   25   25    2   40                                       
CONECT   13   11    2    2   41                                       
CONECT   14   34   27   27   32                                       
CONECT   15   33   33   27   42                                       
CONECT   16    4    5   43                                            
CONECT   17   19   44   45   46                                       
CONECT   18   30    7                                                 
CONECT   19   17   22   22   26                                       
CONECT   20   21    8    8   47                                       
CONECT   21    5    5   20   48                                       
CONECT   22    1   19   19    9                                       
CONECT   23   32   32   31   11                                       
CONECT   24   11   11   25   49                                       
CONECT   25   24   12   12   50                                       
CONECT   26   19   29   29   51                                       
CONECT   27   15   14   14   10                                       
CONECT   28   34   52   53   54                                       
CONECT   29   26   26    3   55                                       
CONECT   30   18   56   57   58                                       
CONECT   31   10   10   23                                            
CONECT   32   14   23   23                                            
CONECT   33   15   15   34                                            
CONECT   34   33   28   14                                            
CONECT   35    4    4                                                 
CONECT   36    1                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
