COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -2.694   1.095  -0.266  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.652  -0.182  -0.804  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.827   1.610   0.925  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.535   2.210   0.361  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.494  -2.091   1.096  1.00  0.00           C  
HETATM    6  C   UNL     1       4.641   1.422  -1.204  1.00  0.00           C  
HETATM    7  C   UNL     1       3.281   0.925  -1.703  1.00  0.00           C  
HETATM    8  C   UNL     1       3.458  -1.088  -0.411  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.321  -0.776   0.332  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.557  -1.943  -2.457  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.571   0.882  -0.199  1.00  0.00           C  
HETATM   12  C   UNL     1       0.967  -2.496   0.957  1.00  0.00           C  
HETATM   13  C   UNL     1       0.060  -0.191   0.632  1.00  0.00           C  
HETATM   14  C   UNL     1       4.900   0.857   0.196  1.00  0.00           C  
HETATM   15  C   UNL     1       4.637   2.951  -1.148  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.367  -0.873  -1.967  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.457   0.439  -1.281  1.00  0.00           O  
HETATM   18  O   UNL     1      -2.330   0.149   0.742  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.414  -3.082   0.658  1.00  0.00           C  
HETATM   20  C   UNL     1       1.140  -1.182   0.193  1.00  0.00           C  
HETATM   21  O   UNL     1       0.223   1.037  -0.081  1.00  0.00           O  
HETATM   22  O   UNL     1       2.431  -0.635   0.474  1.00  0.00           O  
HETATM   23  C   UNL     1       4.825  -0.672   0.139  1.00  0.00           C  
HETATM   24  O   UNL     1       3.268  -0.504  -1.701  1.00  0.00           O  
HETATM   25  O   UNL     1       5.666   0.979  -2.096  1.00  0.00           O  
HETATM   26  N   UNL     1       6.234   1.269   0.652  1.00  0.00           N  
HETATM   27  C   UNL     1       6.307   1.285   2.119  1.00  0.00           C  
HETATM   28  O   UNL     1       4.994  -1.207   1.454  1.00  0.00           O  
HETATM   29  N   UNL     1       2.004  -3.448   0.536  1.00  0.00           N  
HETATM   30  N   UNL     1      -2.821  -2.653   0.808  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.776   2.847   1.446  1.00  0.00           N  
HETATM   32  O   UNL     1      -5.651   2.654   1.447  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.742   0.256   0.331  1.00  0.00           O  
HETATM   34  H   UNL     1      -1.794   1.522  -0.706  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.400  -0.920  -0.043  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.585   0.904   1.720  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.780   2.953  -0.398  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.403  -1.904   2.166  1.00  0.00           H  
HETATM   39  H   UNL     1       2.495   1.296  -1.045  1.00  0.00           H  
HETATM   40  H   UNL     1       3.110   1.289  -2.716  1.00  0.00           H  
HETATM   41  H   UNL     1       3.414  -2.174  -0.493  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.412  -0.963  -0.738  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.949  -2.427  -3.196  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.857   1.598  -0.970  1.00  0.00           H  
HETATM   45  H   UNL     1       1.058  -2.310   2.027  1.00  0.00           H  
HETATM   46  H   UNL     1       0.152  -0.004   1.702  1.00  0.00           H  
HETATM   47  H   UNL     1       4.146   1.234   0.886  1.00  0.00           H  
HETATM   48  H   UNL     1       4.449   3.351  -2.144  1.00  0.00           H  
HETATM   49  H   UNL     1       3.854   3.287  -0.468  1.00  0.00           H  
HETATM   50  H   UNL     1       5.604   3.303  -0.791  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.323  -1.269  -1.622  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.541  -0.153  -2.766  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.538  -4.018   1.202  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.506  -3.269  -0.412  1.00  0.00           H  
HETATM   55  H   UNL     1       1.049  -1.369  -0.877  1.00  0.00           H  
HETATM   56  H   UNL     1       1.033   1.515   0.139  1.00  0.00           H  
HETATM   57  H   UNL     1       5.611  -1.051  -0.513  1.00  0.00           H  
HETATM   58  H   UNL     1       5.562   1.296  -3.003  1.00  0.00           H  
HETATM   59  H   UNL     1       6.487   2.167   0.268  1.00  0.00           H  
HETATM   60  H   UNL     1       5.572   1.987   2.512  1.00  0.00           H  
HETATM   61  H   UNL     1       6.099   0.286   2.504  1.00  0.00           H  
HETATM   62  H   UNL     1       7.306   1.593   2.430  1.00  0.00           H  
HETATM   63  H   UNL     1       4.952  -2.172   1.494  1.00  0.00           H  
HETATM   64  H   UNL     1       1.911  -4.325   1.027  1.00  0.00           H  
HETATM   65  H   UNL     1       1.982  -3.588  -0.463  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.919  -3.572   1.212  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.552  -2.036   1.129  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.916   3.246   1.099  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.334   3.543   1.917  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.489   2.345   1.818  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.261  -0.228  -0.326  1.00  0.00           H  
CONECT    1   18   17    4   34                                       
CONECT    2   16   17   11   35                                       
CONECT    3   11    4   32   36                                       
CONECT    4    1    3   31   37                                       
CONECT    5   19   30    9   38                                       
CONECT    6   14   25    7   15                                       
CONECT    7   24    6   39   40                                       
CONECT    8   23   22   24   41                                       
CONECT    9    5   13   18   42                                       
CONECT   10   16   43                                                 
CONECT   11    2    3   33   44                                       
CONECT   12   29   19   20   45                                       
CONECT   13   20    9   21   46                                       
CONECT   14   23   26    6   47                                       
CONECT   15    6   48   49   50                                       
CONECT   16    2   10   51   52                                       
CONECT   17    2    1                                                 
CONECT   18    9    1                                                 
CONECT   19   12    5   53   54                                       
CONECT   20   12   22   13   55                                       
CONECT   21   13   56                                                 
CONECT   22    8   20                                                 
CONECT   23   28    8   14   57                                       
CONECT   24    8    7                                                 
CONECT   25    6   58                                                 
CONECT   26   27   14   59                                            
CONECT   27   26   60   61   62                                       
CONECT   28   23   63                                                 
CONECT   29   12   64   65                                            
CONECT   30    5   66   67                                            
CONECT   31    4   68   69                                            
CONECT   32    3   70                                                 
CONECT   33   11   71                                                 
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
