COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.416  -0.805   1.652  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.571  -0.838   2.743  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.085  -0.731   4.023  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.447  -0.591   4.218  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.302  -0.556   3.135  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.789  -0.658   1.842  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.702  -0.621   0.675  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.828  -1.439   0.637  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.653  -1.364  -0.486  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.861  -2.186  -0.616  1.00  0.00           C  
HETATM   11  O   UNL     1      -8.175  -2.963   0.267  1.00  0.00           O  
HETATM   12  N   UNL     1      -8.620  -2.070  -1.724  1.00  0.00           N  
HETATM   13  C   UNL     1      -8.302  -1.211  -2.734  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.215  -0.422  -2.698  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.325  -0.473  -1.536  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.240   0.288  -1.459  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.442   0.246  -0.405  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.247   1.121  -0.362  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.548   1.410  -1.534  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.436   2.226  -1.488  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.821   1.665   0.849  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.707   2.480   0.883  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.015   2.757  -0.282  1.00  0.00           C  
HETATM   24  C   UNL     1       0.201   3.647  -0.239  1.00  0.00           C  
HETATM   25  N   UNL     1       1.399   2.828  -0.011  1.00  0.00           N  
HETATM   26  C   UNL     1       2.568   3.672   0.274  1.00  0.00           C  
HETATM   27  C   UNL     1       3.774   2.782   0.583  1.00  0.00           C  
HETATM   28  C   UNL     1       1.658   1.943  -1.155  1.00  0.00           C  
HETATM   29  C   UNL     1       2.864   1.053  -0.846  1.00  0.00           C  
HETATM   30  N   UNL     1       4.033   1.897  -0.562  1.00  0.00           N  
HETATM   31  C   UNL     1       5.174   1.118  -0.344  1.00  0.00           C  
HETATM   32  C   UNL     1       6.388   1.728  -0.059  1.00  0.00           C  
HETATM   33  C   UNL     1       7.514   0.958   0.156  1.00  0.00           C  
HETATM   34  C   UNL     1       5.091  -0.267  -0.408  1.00  0.00           C  
HETATM   35  C   UNL     1       6.217  -1.037  -0.194  1.00  0.00           C  
HETATM   36  C   UNL     1       7.432  -0.426   0.086  1.00  0.00           C  
HETATM   37  N   UNL     1       8.575  -1.207   0.304  1.00  0.00           N  
HETATM   38  C   UNL     1       8.732  -2.371  -0.358  1.00  0.00           C  
HETATM   39  O   UNL     1       7.933  -2.697  -1.210  1.00  0.00           O  
HETATM   40  C   UNL     1       9.900  -3.268  -0.038  1.00  0.00           C  
HETATM   41  C   UNL     1       9.843  -4.515  -0.923  1.00  0.00           C  
HETATM   42  H   UNL     1      -2.013  -0.888   0.653  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.507  -0.948   2.597  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.420  -0.758   4.873  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.843  -0.508   5.219  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.365  -0.447   3.288  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.056  -2.111   1.451  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.950  -1.163  -3.598  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.999   0.245  -3.519  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.876   0.995  -2.476  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.894   2.450  -2.395  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.361   1.449   1.759  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.376   2.901   1.820  1.00  0.00           H  
HETATM   54  H   UNL     1       0.298   4.176  -1.186  1.00  0.00           H  
HETATM   55  H   UNL     1       0.094   4.368   0.571  1.00  0.00           H  
HETATM   56  H   UNL     1       2.788   4.293  -0.595  1.00  0.00           H  
HETATM   57  H   UNL     1       2.356   4.309   1.133  1.00  0.00           H  
HETATM   58  H   UNL     1       4.649   3.406   0.766  1.00  0.00           H  
HETATM   59  H   UNL     1       3.565   2.181   1.468  1.00  0.00           H  
HETATM   60  H   UNL     1       0.783   1.319  -1.338  1.00  0.00           H  
HETATM   61  H   UNL     1       1.867   2.545  -2.040  1.00  0.00           H  
HETATM   62  H   UNL     1       2.645   0.432   0.022  1.00  0.00           H  
HETATM   63  H   UNL     1       3.076   0.416  -1.705  1.00  0.00           H  
HETATM   64  H   UNL     1       6.452   2.805  -0.005  1.00  0.00           H  
HETATM   65  H   UNL     1       8.458   1.433   0.378  1.00  0.00           H  
HETATM   66  H   UNL     1       4.146  -0.742  -0.626  1.00  0.00           H  
HETATM   67  H   UNL     1       6.153  -2.114  -0.243  1.00  0.00           H  
HETATM   68  H   UNL     1       9.254  -0.910   0.930  1.00  0.00           H  
HETATM   69  H   UNL     1      10.831  -2.733  -0.223  1.00  0.00           H  
HETATM   70  H   UNL     1       9.854  -3.565   1.010  1.00  0.00           H  
HETATM   71  H   UNL     1       8.912  -5.050  -0.738  1.00  0.00           H  
HETATM   72  H   UNL     1       9.889  -4.218  -1.971  1.00  0.00           H  
HETATM   73  H   UNL     1      10.688  -5.163  -0.692  1.00  0.00           H  
HETATM   74  H   UNL     1      -9.417  -2.615  -1.805  1.00  0.00           H  
CONECT    1    6    6    2   42                                       
CONECT    2    3    3    1   43                                       
CONECT    3    4    2    2   44                                       
CONECT    4    5    5    3   45                                       
CONECT    5    4    4    6   46                                       
CONECT    6    5    7    1    1                                       
CONECT    7    8    6   17   17                                       
CONECT    8    9    9    7   47                                       
CONECT    9   10    8    8   15                                       
CONECT   10   11   11   12    9                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   74                                            
CONECT   13   12   14   14   48                                       
CONECT   14   13   13   15   49                                       
CONECT   15    9   14   16   16                                       
CONECT   16   15   15   17                                            
CONECT   17    7    7   16   18                                       
CONECT   18   17   21   21   19                                       
CONECT   19   18   20   20   50                                       
CONECT   20   19   19   23   51                                       
CONECT   21   18   18   22   52                                       
CONECT   22   21   23   23   53                                       
CONECT   23   22   22   20   24                                       
CONECT   24   23   25   54   55                                       
CONECT   25   28   24   26                                            
CONECT   26   25   27   56   57                                       
CONECT   27   26   30   58   59                                       
CONECT   28   29   25   60   61                                       
CONECT   29   28   30   62   63                                       
CONECT   30   29   31   27                                            
CONECT   31   34   30   32   32                                       
CONECT   32   31   31   33   64                                       
CONECT   33   36   36   32   65                                       
CONECT   34   35   35   31   66                                       
CONECT   35   34   34   36   67                                       
CONECT   36   35   37   33   33                                       
CONECT   37   36   38   68                                            
CONECT   38   39   39   37   40                                       
CONECT   39   38   38                                                 
CONECT   40   38   41   69   70                                       
CONECT   41   40   71   72   73                                       
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    8                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   37                                                      
CONECT   69   40                                                      
CONECT   70   40                                                      
CONECT   71   41                                                      
CONECT   72   41                                                      
CONECT   73   41                                                      
CONECT   74   12                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
