COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.065  -0.237  -0.363  1.00  0.00           C  
HETATM    2  O   UNL     1       2.079  -1.256  -1.026  1.00  0.00           O  
HETATM    3  C   UNL     1       3.322   0.491  -0.102  1.00  0.00           C  
HETATM    4  C   UNL     1       3.306   1.666   0.662  1.00  0.00           C  
HETATM    5  C   UNL     1       4.459   2.350   0.912  1.00  0.00           C  
HETATM    6  C   UNL     1       5.672   1.886   0.408  1.00  0.00           C  
HETATM    7  C   UNL     1       5.703   0.707  -0.360  1.00  0.00           C  
HETATM    8  C   UNL     1       4.524   0.007  -0.610  1.00  0.00           C  
HETATM    9  C   UNL     1       6.993   0.233  -0.883  1.00  0.00           C  
HETATM   10  C   UNL     1       8.114   0.961  -0.600  1.00  0.00           C  
HETATM   11  C   UNL     1       8.019   2.129   0.172  1.00  0.00           C  
HETATM   12  O   UNL     1       9.032   2.764   0.413  1.00  0.00           O  
HETATM   13  N   UNL     1       6.844   2.568   0.654  1.00  0.00           N  
HETATM   14  O   UNL     1       7.068  -0.895  -1.626  1.00  0.00           O  
HETATM   15  N   UNL     1       0.900   0.231   0.128  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.508   0.471  -0.049  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.311   1.640   0.208  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.526  -1.599   0.901  1.00  0.00           C  
HETATM   19  C   UNL     1       0.567  -2.622   0.733  1.00  0.00           C  
HETATM   20  C   UNL     1       1.755  -2.484   1.425  1.00  0.00           C  
HETATM   21  C   UNL     1       0.378  -3.703  -0.108  1.00  0.00           C  
HETATM   22  C   UNL     1       2.758  -3.424   1.271  1.00  0.00           C  
HETATM   23  C   UNL     1       1.381  -4.642  -0.263  1.00  0.00           C  
HETATM   24  C   UNL     1       2.571  -4.501   0.425  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.854   1.405  -0.550  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.677   0.432  -0.637  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.373   1.183  -0.362  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.196   0.210  -0.449  1.00  0.00           C  
HETATM   29  N   UNL     1     -10.860   1.286   1.295  1.00  0.00           N  
HETATM   30  C   UNL     1     -11.013   0.598   0.115  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.348  -0.488  -0.136  1.00  0.00           C  
HETATM   32  N   UNL     1     -12.127  -0.184  -0.086  1.00  0.00           N  
HETATM   33  C   UNL     1      -3.892   0.961  -0.174  1.00  0.00           C  
HETATM   34  N   UNL     1      -2.764   0.029  -0.258  1.00  0.00           N  
HETATM   35  N   UNL     1     -10.103   0.686  -0.814  1.00  0.00           N  
HETATM   36  H   UNL     1       0.889   1.044   0.657  1.00  0.00           H  
HETATM   37  H   UNL     1       2.370   2.034   1.056  1.00  0.00           H  
HETATM   38  H   UNL     1       4.543  -0.900  -1.196  1.00  0.00           H  
HETATM   39  H   UNL     1       4.431   3.254   1.501  1.00  0.00           H  
HETATM   40  H   UNL     1       6.820   3.380   1.183  1.00  0.00           H  
HETATM   41  H   UNL     1       9.075   0.636  -0.971  1.00  0.00           H  
HETATM   42  H   UNL     1       7.963  -1.115  -1.918  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.312  -0.925  -1.134  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.922  -0.905  -0.463  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.496  -2.076   0.760  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.474  -1.172   1.903  1.00  0.00           H  
HETATM   47  H   UNL     1       1.901  -1.643   2.086  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.553  -3.813  -0.645  1.00  0.00           H  
HETATM   49  H   UNL     1       3.687  -3.315   1.811  1.00  0.00           H  
HETATM   50  H   UNL     1       1.233  -5.486  -0.920  1.00  0.00           H  
HETATM   51  H   UNL     1       3.355  -5.235   0.305  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.891   1.842   0.448  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.728   2.197  -1.288  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.804  -0.359   0.101  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.641  -0.005  -1.635  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.246   1.974  -1.100  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.410   1.620   0.636  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.323  -0.581   0.289  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.159  -0.227  -1.447  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.765   1.752  -0.912  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.928   1.398   0.824  1.00  0.00           H  
HETATM   62  H   UNL     1     -11.458   1.112   2.039  1.00  0.00           H  
HETATM   63  H   UNL     1     -10.154   1.945   1.384  1.00  0.00           H  
HETATM   64  H   UNL     1     -12.804  -0.250   0.606  1.00  0.00           H  
HETATM   65  H   UNL     1     -12.235  -0.669  -0.918  1.00  0.00           H  
CONECT    1    2    2    3   15                                       
CONECT    2    1    1                                                 
CONECT    3    1    4    8    8                                       
CONECT    4    3    5    5   37                                       
CONECT    5    4    4    6   39                                       
CONECT    6    5    7    7   13                                       
CONECT    7    6    6    8    9                                       
CONECT    8    3    3    7   38                                       
CONECT    9    7   10   10   14                                       
CONECT   10    9    9   11   41                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13    6   11   40                                            
CONECT   14    9   42                                                 
CONECT   15    1   31   36                                            
CONECT   16   17   17   31   34                                       
CONECT   17   16   16                                                 
CONECT   18   19   31   45   46                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   22   22   47                                       
CONECT   21   19   19   23   48                                       
CONECT   22   20   20   24   49                                       
CONECT   23   21   24   24   50                                       
CONECT   24   22   23   23   51                                       
CONECT   25   26   35   52   53                                       
CONECT   26   25   27   54   55                                       
CONECT   27   26   28   56   57                                       
CONECT   28   27   33   58   59                                       
CONECT   29   30   62   63                                            
CONECT   30   29   32   35   35                                       
CONECT   31   15   16   18   43                                       
CONECT   32   30   64   65                                            
CONECT   33   28   34   60   61                                       
CONECT   34   16   33   44                                            
CONECT   35   25   30   30                                            
CONECT   36   15                                                      
CONECT   37    4                                                      
CONECT   38    8                                                      
CONECT   39    5                                                      
CONECT   40   13                                                      
CONECT   41   10                                                      
CONECT   42   14                                                      
CONECT   43   31                                                      
CONECT   44   34                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
