COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.092   1.213  -0.063  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.222   2.295  -0.058  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.878   2.080   0.263  1.00  0.00           C  
HETATM    4  C   UNL     1       1.246   2.152   0.701  1.00  0.00           C  
HETATM    5  C   UNL     1       2.641   2.684   0.909  1.00  0.00           C  
HETATM    6  C   UNL     1       2.626   3.728   2.027  1.00  0.00           C  
HETATM    7  C   UNL     1       3.138   3.330  -0.386  1.00  0.00           C  
HETATM    8  O   UNL     1       4.500   3.731  -0.225  1.00  0.00           O  
HETATM    9  C   UNL     1       1.759  -0.263   1.210  1.00  0.00           C  
HETATM   10  C   UNL     1       2.320  -0.503  -1.212  1.00  0.00           C  
HETATM   11  C   UNL     1       3.462  -0.612  -2.226  1.00  0.00           C  
HETATM   12  C   UNL     1       4.312  -1.843  -1.906  1.00  0.00           C  
HETATM   13  C   UNL     1       5.453  -1.951  -2.920  1.00  0.00           C  
HETATM   14  C   UNL     1       4.892  -1.711  -0.497  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.465   0.769   0.568  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.987  -1.652   0.859  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.187  -4.172   1.516  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.261  -2.698  -0.028  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.516   1.426  -0.407  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.624   1.137  -0.816  1.00  0.00           C  
HETATM   21  N   UNL     1       0.215   2.872   0.363  1.00  0.00           N  
HETATM   22  C   UNL     1       5.065   4.349  -1.384  1.00  0.00           C  
HETATM   23  N   UNL     1       0.881   0.850   0.840  1.00  0.00           N  
HETATM   24  C   UNL     1       2.337  -0.014   2.605  1.00  0.00           C  
HETATM   25  C   UNL     1       2.901  -0.371   0.197  1.00  0.00           C  
HETATM   26  C   UNL     1       3.751  -1.602   0.516  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.406  -0.266   0.540  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.668  -0.013   0.230  1.00  0.00           N  
HETATM   29  C   UNL     1      -0.320  -1.934   2.049  1.00  0.00           C  
HETATM   30  N   UNL     1       0.052  -3.165   2.334  1.00  0.00           N  
HETATM   31  C   UNL     1      -0.849  -3.975   0.317  1.00  0.00           C  
HETATM   32 CL   UNL     1      -1.161  -5.313  -0.744  1.00  0.00          Cl  
HETATM   33  N   UNL     1      -5.076   2.557  -0.715  1.00  0.00           N  
HETATM   34  O   UNL     1      -6.256   2.421  -0.948  1.00  0.00           O  
HETATM   35  O   UNL     1      -7.737   0.675  -0.984  1.00  0.00           O  
HETATM   36  N   UNL     1      -5.506   0.455  -0.468  1.00  0.00           N  
HETATM   37  H   UNL     1      -2.577   3.287  -0.298  1.00  0.00           H  
HETATM   38  H   UNL     1       3.305   1.865   1.185  1.00  0.00           H  
HETATM   39  H   UNL     1       1.962   4.547   1.751  1.00  0.00           H  
HETATM   40  H   UNL     1       2.272   3.268   2.949  1.00  0.00           H  
HETATM   41  H   UNL     1       3.635   4.114   2.177  1.00  0.00           H  
HETATM   42  H   UNL     1       3.064   2.611  -1.202  1.00  0.00           H  
HETATM   43  H   UNL     1       2.527   4.203  -0.614  1.00  0.00           H  
HETATM   44  H   UNL     1       1.188  -1.191   1.215  1.00  0.00           H  
HETATM   45  H   UNL     1       1.715   0.374  -1.440  1.00  0.00           H  
HETATM   46  H   UNL     1       1.700  -1.398  -1.267  1.00  0.00           H  
HETATM   47  H   UNL     1       3.049  -0.706  -3.230  1.00  0.00           H  
HETATM   48  H   UNL     1       4.082   0.283  -2.171  1.00  0.00           H  
HETATM   49  H   UNL     1       3.691  -2.737  -1.961  1.00  0.00           H  
HETATM   50  H   UNL     1       6.074  -1.057  -2.865  1.00  0.00           H  
HETATM   51  H   UNL     1       6.059  -2.828  -2.692  1.00  0.00           H  
HETATM   52  H   UNL     1       5.040  -2.045  -3.924  1.00  0.00           H  
HETATM   53  H   UNL     1       5.498  -2.588  -0.269  1.00  0.00           H  
HETATM   54  H   UNL     1       5.513  -0.816  -0.442  1.00  0.00           H  
HETATM   55  H   UNL     1       0.136  -5.166   1.788  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.780  -2.515  -0.957  1.00  0.00           H  
HETATM   57  H   UNL     1       5.031   3.651  -2.220  1.00  0.00           H  
HETATM   58  H   UNL     1       4.494   5.243  -1.633  1.00  0.00           H  
HETATM   59  H   UNL     1       6.100   4.623  -1.181  1.00  0.00           H  
HETATM   60  H   UNL     1       1.525   0.178   3.306  1.00  0.00           H  
HETATM   61  H   UNL     1       2.897  -0.891   2.929  1.00  0.00           H  
HETATM   62  H   UNL     1       3.002   0.850   2.574  1.00  0.00           H  
HETATM   63  H   UNL     1       3.521   0.523   0.252  1.00  0.00           H  
HETATM   64  H   UNL     1       3.130  -2.497   0.461  1.00  0.00           H  
HETATM   65  H   UNL     1       4.164  -1.508   1.521  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.105  -1.136   2.744  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.419  -0.495  -0.294  1.00  0.00           H  
CONECT    1   19   28   28    2                                       
CONECT    2    1    3    3   37                                       
CONECT    3    2    2   15   21                                       
CONECT    4   21   21   23    5                                       
CONECT    5    4    7    6   38                                       
CONECT    6    5   39   40   41                                       
CONECT    7    8    5   42   43                                       
CONECT    8   22    7                                                 
CONECT    9   23   25   24   44                                       
CONECT   10   11   25   45   46                                       
CONECT   11   10   12   47   48                                       
CONECT   12   11   13   14   49                                       
CONECT   13   12   50   51   52                                       
CONECT   14   12   26   53   54                                       
CONECT   15   27   27    3   23                                       
CONECT   16   18   27   29   29                                       
CONECT   17   31   30   30   55                                       
CONECT   18   31   31   16   56                                       
CONECT   19   33   33   36    1                                       
CONECT   20   35   35   34   36                                       
CONECT   21    3    4    4                                            
CONECT   22    8   57   58   59                                       
CONECT   23   15    9    4                                            
CONECT   24    9   60   61   62                                       
CONECT   25   10    9   26   63                                       
CONECT   26   25   14   64   65                                       
CONECT   27   28   16   15   15                                       
CONECT   28    1    1   27                                            
CONECT   29   16   16   30   66                                       
CONECT   30   17   17   29                                            
CONECT   31   32   18   18   17                                       
CONECT   32   31                                                      
CONECT   33   34   19   19                                            
CONECT   34   20   33                                                 
CONECT   35   20   20                                                 
CONECT   36   20   19   67                                            
CONECT   37    2                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   26                                                      
CONECT   66   29                                                      
CONECT   67   36                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
