COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -4.422   5.418   1.109  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.194   4.052   0.460  1.00  0.00           C  
HETATM    3  C   UNL     1       2.766   1.613   1.115  1.00  0.00           C  
HETATM    4  C   UNL     1       2.141   2.273  -1.501  1.00  0.00           C  
HETATM    5  C   UNL     1       1.135   2.125  -0.563  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.305   2.317  -0.962  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.593   2.274  -0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.376  -1.981   0.410  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.490  -2.601  -0.162  1.00  0.00           C  
HETATM   10  C   UNL     1       0.564  -4.150   0.885  1.00  0.00           C  
HETATM   11  C   UNL     1       0.661  -2.767   0.932  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.370   5.295  -0.415  1.00  0.00           C  
HETATM   13  C   UNL     1       3.775   1.744   0.172  1.00  0.00           C  
HETATM   14  C   UNL     1       3.461   2.081  -1.137  1.00  0.00           C  
HETATM   15  C   UNL     1       1.448   1.800   0.744  1.00  0.00           C  
HETATM   16 CL   UNL     1       4.722   2.260  -2.316  1.00  0.00          Cl  
HETATM   17  O   UNL     1       5.070   1.539   0.536  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.211   1.681   0.094  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.473   1.671  -0.577  1.00  0.00           O  
HETATM   20  N   UNL     1      -2.850   3.475   0.552  1.00  0.00           N  
HETATM   21  N   UNL     1      -1.278   0.219  -0.156  1.00  0.00           N  
HETATM   22  C   UNL     1       5.377   0.261   1.104  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.298  -0.509   0.467  1.00  0.00           C  
HETATM   24  O   UNL     1       0.613   0.044   1.051  1.00  0.00           O  
HETATM   25  O   UNL     1       1.762  -2.181   1.468  1.00  0.00           O  
HETATM   26  C   UNL     1       3.017  -2.770   1.183  1.00  0.00           C  
HETATM   27  C   UNL     1       4.135  -1.808   1.491  1.00  0.00           C  
HETATM   28  C   UNL     1       4.257  -0.701   0.802  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.303   3.086   0.500  1.00  0.00           C  
HETATM   30  N   UNL     1      -6.160   2.340   0.532  1.00  0.00           N  
HETATM   31  C   UNL     1      -0.544  -4.749   0.321  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.569  -3.976  -0.201  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.774  -4.642  -0.814  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.439  -5.548  -2.012  1.00  0.00           C  
HETATM   35  N   UNL     1      -3.412  -6.502  -1.436  1.00  0.00           N  
HETATM   36  C   UNL     1      -3.207  -5.928  -0.088  1.00  0.00           C  
HETATM   37  H   UNL     1      -5.395   5.602   1.566  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.573   5.888   1.605  1.00  0.00           H  
HETATM   39  H   UNL     1       3.009   1.362   2.136  1.00  0.00           H  
HETATM   40  H   UNL     1       1.894   2.535  -2.519  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.524   3.383  -1.034  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.482   1.842  -1.927  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.290  -2.002  -0.573  1.00  0.00           H  
HETATM   44  H   UNL     1       1.358  -4.760   1.289  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.308   5.397  -0.961  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.487   5.683  -0.922  1.00  0.00           H  
HETATM   47  H   UNL     1       0.662   1.692   1.476  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.801   1.866   1.087  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.146   3.958   1.013  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.960  -0.188  -0.713  1.00  0.00           H  
HETATM   51  H   UNL     1       6.305  -0.115   0.673  1.00  0.00           H  
HETATM   52  H   UNL     1       5.490   0.361   2.183  1.00  0.00           H  
HETATM   53  H   UNL     1       3.141  -3.669   1.786  1.00  0.00           H  
HETATM   54  H   UNL     1       3.062  -3.034   0.126  1.00  0.00           H  
HETATM   55  H   UNL     1       4.838  -2.035   2.280  1.00  0.00           H  
HETATM   56  H   UNL     1       3.551  -0.479   0.015  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.614  -5.826   0.287  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.592  -3.947  -1.005  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.744  -5.136  -2.974  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.412  -5.913  -2.013  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.064  -7.447  -1.484  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.405  -6.406   0.475  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.126  -5.819   0.488  1.00  0.00           H  
CONECT    1    2   12   37   38                                       
CONECT    2   29    1   20   12                                       
CONECT    3   13   13   15   39                                       
CONECT    4   14   14    5   40                                       
CONECT    5    4    6   15   15                                       
CONECT    6    5   18   41   42                                       
CONECT    7   19   19   18   20                                       
CONECT    8    9   23   11   11                                       
CONECT    9   32   32    8   43                                       
CONECT   10   31   31   11   44                                       
CONECT   11    8    8   10   25                                       
CONECT   12    1    2   45   46                                       
CONECT   13   14   17    3    3                                       
CONECT   14   16    4    4   13                                       
CONECT   15    5    5    3   47                                       
CONECT   16   14                                                      
CONECT   17   13   22                                                 
CONECT   18    6    7   21   48                                       
CONECT   19    7    7                                                 
CONECT   20    7    2   49                                            
CONECT   21   18   23   50                                            
CONECT   22   17   28   51   52                                       
CONECT   23   21    8   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   11   26                                                 
CONECT   26   27   25   53   54                                       
CONECT   27   28   28   26   55                                       
CONECT   28   27   27   22   56                                       
CONECT   29   30   30   30    2                                       
CONECT   30   29   29   29                                            
CONECT   31   32   10   10   57                                       
CONECT   32   33    9    9   31                                       
CONECT   33   36   34   32   58                                       
CONECT   34   33   35   59   60                                       
CONECT   35   36   34   61                                            
CONECT   36   33   35   62   63                                       
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
CONECT   60   34                                                      
CONECT   61   35                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
