COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.740  -0.630   0.424  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.748   0.737   0.191  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.794   1.312  -0.518  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.824   0.523  -0.991  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.815  -0.841  -0.757  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.776  -1.415  -0.047  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.610  -1.260   1.196  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.517  -1.600   0.253  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.506  -2.343   0.801  1.00  0.00           C  
HETATM   10  C   UNL     1       0.688  -2.687  -0.046  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.572  -2.717   1.953  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.736   1.516   0.654  1.00  0.00           O  
HETATM   13  C   UNL     1       1.183  -4.129   0.283  1.00  0.00           C  
HETATM   14  C   UNL     1       1.887  -3.844   1.648  1.00  0.00           C  
HETATM   15  C   UNL     1       2.631  -2.519   1.339  1.00  0.00           C  
HETATM   16  N   UNL     1       1.834  -1.825   0.310  1.00  0.00           N  
HETATM   17  C   UNL     1       2.098  -0.613  -0.207  1.00  0.00           C  
HETATM   18  C   UNL     1       3.270   0.193   0.290  1.00  0.00           C  
HETATM   19  N   UNL     1       3.151   1.570  -0.251  1.00  0.00           N  
HETATM   20  C   UNL     1       2.181   2.333   0.341  1.00  0.00           C  
HETATM   21  O   UNL     1       1.501   1.884   1.239  1.00  0.00           O  
HETATM   22  C   UNL     1       1.977   3.744  -0.148  1.00  0.00           C  
HETATM   23  C   UNL     1       0.635   4.272   0.360  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.437   3.351  -0.091  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.686   3.655   0.381  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.858   4.613   1.104  1.00  0.00           O  
HETATM   27  C   UNL     1      -2.842   2.774  -0.015  1.00  0.00           C  
HETATM   28  O   UNL     1       1.387  -0.163  -1.080  1.00  0.00           O  
HETATM   29  C   UNL     1       4.575  -0.441  -0.196  1.00  0.00           C  
HETATM   30  C   UNL     1       4.616  -0.416  -1.725  1.00  0.00           C  
HETATM   31  C   UNL     1       5.921  -1.050  -2.211  1.00  0.00           C  
HETATM   32  C   UNL     1       7.109  -0.261  -1.656  1.00  0.00           C  
HETATM   33  C   UNL     1       7.068  -0.286  -0.127  1.00  0.00           C  
HETATM   34  C   UNL     1       5.763   0.348   0.359  1.00  0.00           C  
HETATM   35 CL   UNL     1      -7.112  -1.831  -1.350  1.00  0.00          Cl  
HETATM   36  H   UNL     1      -4.801   2.376  -0.701  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.637   0.971  -1.543  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.771  -2.480   0.136  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.963  -2.166   1.688  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.242  -0.556   1.942  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.519  -1.320  -0.676  1.00  0.00           H  
HETATM   42  H   UNL     1       0.457  -2.602  -1.103  1.00  0.00           H  
HETATM   43  H   UNL     1       1.892  -4.487  -0.464  1.00  0.00           H  
HETATM   44  H   UNL     1       0.348  -4.819   0.401  1.00  0.00           H  
HETATM   45  H   UNL     1       2.590  -4.639   1.898  1.00  0.00           H  
HETATM   46  H   UNL     1       1.155  -3.706   2.444  1.00  0.00           H  
HETATM   47  H   UNL     1       3.630  -2.732   0.958  1.00  0.00           H  
HETATM   48  H   UNL     1       2.693  -1.908   2.239  1.00  0.00           H  
HETATM   49  H   UNL     1       3.260   0.223   1.379  1.00  0.00           H  
HETATM   50  H   UNL     1       3.715   1.902  -0.966  1.00  0.00           H  
HETATM   51  H   UNL     1       1.983   3.755  -1.238  1.00  0.00           H  
HETATM   52  H   UNL     1       2.782   4.378   0.225  1.00  0.00           H  
HETATM   53  H   UNL     1       0.456   5.268  -0.045  1.00  0.00           H  
HETATM   54  H   UNL     1       0.647   4.314   1.449  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.267   2.595  -0.674  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.824   2.614  -1.093  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.779   3.256   0.265  1.00  0.00           H  
HETATM   58  H   UNL     1       4.630  -1.473   0.152  1.00  0.00           H  
HETATM   59  H   UNL     1       3.770  -0.978  -2.120  1.00  0.00           H  
HETATM   60  H   UNL     1       4.562   0.615  -2.073  1.00  0.00           H  
HETATM   61  H   UNL     1       5.976  -2.081  -1.863  1.00  0.00           H  
HETATM   62  H   UNL     1       5.950  -1.032  -3.300  1.00  0.00           H  
HETATM   63  H   UNL     1       8.039  -0.712  -2.002  1.00  0.00           H  
HETATM   64  H   UNL     1       7.054   0.771  -2.004  1.00  0.00           H  
HETATM   65  H   UNL     1       7.123  -1.317   0.221  1.00  0.00           H  
HETATM   66  H   UNL     1       7.914   0.276   0.268  1.00  0.00           H  
HETATM   67  H   UNL     1       5.708   1.379   0.011  1.00  0.00           H  
HETATM   68  H   UNL     1       5.734   0.330   1.448  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   12                                       
CONECT    3    2    4    4   36                                       
CONECT    4    3    3    5   37                                       
CONECT    5    4    6    6   35                                       
CONECT    6    1    5    5   38                                       
CONECT    7    1    8   39   40                                       
CONECT    8    7    9   41                                            
CONECT    9    8   10   11   11                                       
CONECT   10    9   13   16   42                                       
CONECT   11    9    9                                                 
CONECT   12    2   27                                                 
CONECT   13   10   14   43   44                                       
CONECT   14   13   15   45   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   10   15   17                                            
CONECT   17   16   18   28   28                                       
CONECT   18   17   19   29   49                                       
CONECT   19   18   20   50                                            
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   51   52                                       
CONECT   23   22   24   53   54                                       
CONECT   24   23   25   55                                            
CONECT   25   24   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   12   25   56   57                                       
CONECT   28   17   17                                                 
CONECT   29   18   30   34   58                                       
CONECT   30   29   31   59   60                                       
CONECT   31   30   32   61   62                                       
CONECT   32   31   33   63   64                                       
CONECT   33   32   34   65   66                                       
CONECT   34   29   33   67   68                                       
CONECT   35    5                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   34                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
