COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.286   2.145   0.887  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.069   1.482   0.563  1.00  0.00           C  
HETATM    3  C   UNL     1       1.685   2.776  -0.423  1.00  0.00           C  
HETATM    4  C   UNL     1       1.909   4.138  -0.493  1.00  0.00           C  
HETATM    5  C   UNL     1       2.275   4.717  -1.694  1.00  0.00           C  
HETATM    6  C   UNL     1       2.417   3.934  -2.824  1.00  0.00           C  
HETATM    7  C   UNL     1       2.193   2.571  -2.753  1.00  0.00           C  
HETATM    8  C   UNL     1       1.833   1.992  -1.551  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.902   2.848   0.393  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.663   2.171   0.415  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.267   0.828   0.262  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.668   3.141   0.647  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.250  -5.034  -0.664  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.489  -3.297  -0.250  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.290  -4.210  -0.271  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.051  -3.435   0.180  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.529  -5.387   0.676  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.074  -4.735  -1.692  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.467  -1.959  -0.058  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.790  -1.493  -0.117  1.00  0.00           C  
HETATM   21  C   UNL     1       2.511   1.499   1.536  1.00  0.00           C  
HETATM   22  C   UNL     1       4.213  -0.094   1.024  1.00  0.00           C  
HETATM   23  C   UNL     1       6.018  -1.691   0.664  1.00  0.00           C  
HETATM   24  C   UNL     1       6.509  -2.623  -0.445  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.774  -3.669  -0.425  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.202  -0.163   0.032  1.00  0.00           N  
HETATM   27  N   UNL     1      -3.311   4.339   0.756  1.00  0.00           N  
HETATM   28  N   UNL     1      -4.684   4.116   0.594  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.395   2.755   0.713  1.00  0.00           N  
HETATM   30  N   UNL     1       0.265   1.123   0.645  1.00  0.00           N  
HETATM   31  N   UNL     1       4.824  -0.975   0.207  1.00  0.00           N  
HETATM   32  N   UNL     1       7.706  -3.341   0.013  1.00  0.00           N  
HETATM   33  N   UNL     1      -1.974   0.536   0.343  1.00  0.00           N  
HETATM   34  N   UNL     1      -4.574  -2.522  -0.338  1.00  0.00           N  
HETATM   35  O   UNL     1       3.116   0.564   0.604  1.00  0.00           O  
HETATM   36  O   UNL     1       4.653   0.107   2.138  1.00  0.00           O  
HETATM   37  H   UNL     1       0.884   2.910   1.551  1.00  0.00           H  
HETATM   38  H   UNL     1       1.798   4.750   0.389  1.00  0.00           H  
HETATM   39  H   UNL     1       2.449   5.781  -1.750  1.00  0.00           H  
HETATM   40  H   UNL     1       2.698   4.386  -3.763  1.00  0.00           H  
HETATM   41  H   UNL     1       2.304   1.959  -3.636  1.00  0.00           H  
HETATM   42  H   UNL     1       1.658   0.927  -1.496  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.868   2.390   0.237  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.378  -5.547   0.289  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.205  -4.999  -1.189  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.522  -5.572  -1.271  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.205  -3.062   1.192  1.00  0.00           H  
HETATM   48  H   UNL     1       0.817  -4.096   0.165  1.00  0.00           H  
HETATM   49  H   UNL     1       0.120  -2.597  -0.495  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.412  -5.940   0.355  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.662  -6.048   0.661  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.683  -5.014   1.689  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.816  -3.905  -2.351  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.263  -5.463  -1.691  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.988  -5.210  -2.047  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.587  -1.355   0.112  1.00  0.00           H  
HETATM   57  H   UNL     1       3.234   2.271   1.797  1.00  0.00           H  
HETATM   58  H   UNL     1       2.206   0.967   2.437  1.00  0.00           H  
HETATM   59  H   UNL     1       5.773  -2.278   1.549  1.00  0.00           H  
HETATM   60  H   UNL     1       6.800  -0.974   0.909  1.00  0.00           H  
HETATM   61  H   UNL     1       5.727  -3.341  -0.690  1.00  0.00           H  
HETATM   62  H   UNL     1       6.754  -2.036  -1.331  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.143   0.063  -0.025  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.889   5.197   0.917  1.00  0.00           H  
HETATM   65  H   UNL     1       0.524   0.194   0.541  1.00  0.00           H  
HETATM   66  H   UNL     1       4.473  -1.136  -0.683  1.00  0.00           H  
HETATM   67  H   UNL     1       7.522  -3.842   0.869  1.00  0.00           H  
HETATM   68  H   UNL     1       8.051  -3.964  -0.703  1.00  0.00           H  
CONECT    1    3   21   30   37                                       
CONECT    2   30   33   33   29                                       
CONECT    3    8    8    4    1                                       
CONECT    4    5    5    3   38                                       
CONECT    5    6    4    4   39                                       
CONECT    6    7    7    5   40                                       
CONECT    7    6    6    8   41                                       
CONECT    8    7    3    3   42                                       
CONECT    9   10   28   28   43                                       
CONECT   10   11   11   12    9                                       
CONECT   11   33   26   10   10                                       
CONECT   12   29   29   10   27                                       
CONECT   13   25   44   45   46                                       
CONECT   14   15   19   19   25                                       
CONECT   15   18   17   14   16                                       
CONECT   16   15   47   48   49                                       
CONECT   17   15   50   51   52                                       
CONECT   18   15   53   54   55                                       
CONECT   19   14   14   20   56                                       
CONECT   20   19   34   34   26                                       
CONECT   21    1   35   57   58                                       
CONECT   22   36   36   35   31                                       
CONECT   23   24   31   59   60                                       
CONECT   24   23   32   61   62                                       
CONECT   25   14   13   34                                            
CONECT   26   20   11   63                                            
CONECT   27   12   28   64                                            
CONECT   28   27    9    9                                            
CONECT   29    2   12   12                                            
CONECT   30    1    2   65                                            
CONECT   31   22   23   66                                            
CONECT   32   24   67   68                                            
CONECT   33    2    2   11                                            
CONECT   34   25   20   20                                            
CONECT   35   21   22                                                 
CONECT   36   22   22                                                 
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
