COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.745  -3.811   0.147  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.953  -2.656   0.144  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.150  -5.042   0.105  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.747  -5.103   0.060  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.008  -3.896   0.059  1.00  0.00           C  
HETATM    6  C   UNL     1       0.460  -3.973   0.011  1.00  0.00           C  
HETATM    7  C   UNL     1       1.068  -5.250  -0.032  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.077  -6.346   0.015  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.492   2.484  -1.471  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.721   5.702   1.177  1.00  0.00           C  
HETATM   11  C   UNL     1       2.524  -2.941  -0.035  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.606  -1.327   0.190  1.00  0.00           C  
HETATM   13  C   UNL     1       0.271  -6.416  -0.028  1.00  0.00           C  
HETATM   14  C   UNL     1       2.470  -5.334  -0.078  1.00  0.00           C  
HETATM   15  C   UNL     1       3.190  -4.171  -0.079  1.00  0.00           C  
HETATM   16  C   UNL     1       3.313  -1.687  -0.036  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.897   5.791   0.435  1.00  0.00           C  
HETATM   18  C   UNL     1       3.423   0.688  -0.092  1.00  0.00           C  
HETATM   19  C   UNL     1       4.679   0.772   0.476  1.00  0.00           C  
HETATM   20  C   UNL     1       5.384   1.983   0.345  1.00  0.00           C  
HETATM   21  C   UNL     1       4.784   3.057  -0.358  1.00  0.00           C  
HETATM   22  C   UNL     1       2.895   1.792  -0.773  1.00  0.00           C  
HETATM   23  C   UNL     1       6.666   2.144   0.896  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.417   4.700  -0.191  1.00  0.00           C  
HETATM   25  C   UNL     1       5.489   4.266  -0.489  1.00  0.00           C  
HETATM   26  C   UNL     1       7.318   3.330   0.748  1.00  0.00           C  
HETATM   27  C   UNL     1       6.729   4.387   0.058  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.056   4.520   1.293  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.473   1.046   0.121  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.657   1.211  -0.608  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.906   2.133   0.759  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.564   3.373   0.662  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.763   3.459  -0.090  1.00  0.00           C  
HETATM   34  C   UNL     1       2.961   4.035  -1.610  1.00  0.00           C  
HETATM   35  N   UNL     1      -1.633  -2.729   0.101  1.00  0.00           N  
HETATM   36  N   UNL     1      -2.857  -0.207   0.188  1.00  0.00           N  
HETATM   37  N   UNL     1       3.564   2.912  -0.887  1.00  0.00           N1+
HETATM   38  N   UNL     1       2.684  -0.495   0.006  1.00  0.00           N  
HETATM   39  N   UNL     1       1.203  -2.876   0.009  1.00  0.00           N  
HETATM   40  N   UNL     1      -5.255   2.373  -0.694  1.00  0.00           N1+
HETATM   41  O   UNL     1       4.527  -1.733  -0.076  1.00  0.00           O  
HETATM   42  O   UNL     1      -4.818  -1.247   0.231  1.00  0.00           O  
HETATM   43  H   UNL     1      -4.821  -3.730   0.188  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.744  -5.944   0.108  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.654  -7.259   0.016  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.346   2.293  -0.822  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.570   3.489  -1.887  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.479   1.755  -2.281  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.330   6.584   1.663  1.00  0.00           H  
HETATM   50  H   UNL     1       0.749  -7.384  -0.062  1.00  0.00           H  
HETATM   51  H   UNL     1       2.966  -6.293  -0.112  1.00  0.00           H  
HETATM   52  H   UNL     1       4.269  -4.202  -0.115  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.403   6.741   0.354  1.00  0.00           H  
HETATM   54  H   UNL     1       5.107  -0.066   1.006  1.00  0.00           H  
HETATM   55  H   UNL     1       1.913   1.718  -1.215  1.00  0.00           H  
HETATM   56  H   UNL     1       7.131   1.331   1.434  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.329   4.786  -0.762  1.00  0.00           H  
HETATM   58  H   UNL     1       5.048   5.095  -1.022  1.00  0.00           H  
HETATM   59  H   UNL     1       8.303   3.453   1.172  1.00  0.00           H  
HETATM   60  H   UNL     1       7.267   5.318  -0.046  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.143   4.464   1.867  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.088   0.358  -1.112  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.993   2.031   1.327  1.00  0.00           H  
HETATM   64  H   UNL     1       3.231   3.974  -2.664  1.00  0.00           H  
HETATM   65  H   UNL     1       1.877   3.991  -1.509  1.00  0.00           H  
HETATM   66  H   UNL     1       3.327   4.973  -1.195  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.890  -0.271   0.232  1.00  0.00           H  
HETATM   68  H   UNL     1       1.720  -0.459   0.104  1.00  0.00           H  
CONECT    1    3    3    2   43                                       
CONECT    2    1   12   35   35                                       
CONECT    3    1    1    4   44                                       
CONECT    4    3    8    8    5                                       
CONECT    5    4   35    6    6                                       
CONECT    6    5    5    7   39                                       
CONECT    7   13   13    6   14                                       
CONECT    8    4    4   13   45                                       
CONECT    9   40   46   47   48                                       
CONECT   10   17   17   28   49                                       
CONECT   11   39   39   15   16                                       
CONECT   12   42   42    2   36                                       
CONECT   13    8    7    7   50                                       
CONECT   14    7   15   15   51                                       
CONECT   15   14   14   11   52                                       
CONECT   16   11   38   41   41                                       
CONECT   17   24   10   10   53                                       
CONECT   18   38   19   19   22                                       
CONECT   19   18   18   20   54                                       
CONECT   20   19   23   23   21                                       
CONECT   21   20   37   25   25                                       
CONECT   22   18   37   37   55                                       
CONECT   23   20   20   26   56                                       
CONECT   24   33   33   17   57                                       
CONECT   25   21   21   27   58                                       
CONECT   26   23   27   27   59                                       
CONECT   27   26   26   25   60                                       
CONECT   28   32   32   10   61                                       
CONECT   29   30   36   31   31                                       
CONECT   30   40   40   29   62                                       
CONECT   31   29   29   32   63                                       
CONECT   32   33   31   28   28                                       
CONECT   33   40   24   24   32                                       
CONECT   34   37   64   65   66                                       
CONECT   35    2    2    5                                            
CONECT   36   12   29   67                                            
CONECT   37   22   22   21   34                                       
CONECT   38   16   18   68                                            
CONECT   39    6   11   11                                            
CONECT   40    9   30   30   33                                       
CONECT   41   16   16                                                 
CONECT   42   12   12                                                 
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   19                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   36                                                      
CONECT   68   38                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
