COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.611   0.546   1.588  1.00  0.00           C  
HETATM    2  C   UNL     1       3.088  -0.882   1.923  1.00  0.00           C  
HETATM    3  C   UNL     1       4.399  -1.064   1.128  1.00  0.00           C  
HETATM    4  N   UNL     1       4.898   0.318   0.910  1.00  0.00           N  
HETATM    5  C   UNL     1       3.674   1.107   0.619  1.00  0.00           C  
HETATM    6  C   UNL     1       5.785   0.363  -0.160  1.00  0.00           C  
HETATM    7  C   UNL     1       6.951  -0.395  -0.121  1.00  0.00           C  
HETATM    8  C   UNL     1       7.824  -0.341  -1.193  1.00  0.00           C  
HETATM    9  C   UNL     1       7.502   0.473  -2.270  1.00  0.00           C  
HETATM   10  C   UNL     1       6.328   1.199  -2.242  1.00  0.00           C  
HETATM   11  N   UNL     1       5.511   1.124  -1.208  1.00  0.00           N  
HETATM   12  C   UNL     1      -5.187   2.093   0.145  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.610   0.947  -0.524  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.814  -0.161  -0.588  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.968   2.141   0.755  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.127   1.021   0.708  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.558  -0.143   0.027  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.688  -1.260  -0.005  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.515  -1.158   0.604  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.155  -0.049   1.229  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.919   1.016   1.292  1.00  0.00           N  
HETATM   22 CL   UNL     1      -7.169   0.927  -1.287  1.00  0.00          Cl  
HETATM   23  N   UNL     1      -3.052  -2.422  -0.652  1.00  0.00           N  
HETATM   24  C   UNL     1       0.194  -0.006   1.900  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.136  -2.715  -1.763  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.116  -3.550   0.287  1.00  0.00           C  
HETATM   27  C   UNL     1       1.241   0.503   0.907  1.00  0.00           C  
HETATM   28  H   UNL     1       2.566   1.152   2.493  1.00  0.00           H  
HETATM   29  H   UNL     1       3.277  -0.977   2.992  1.00  0.00           H  
HETATM   30  H   UNL     1       2.346  -1.614   1.602  1.00  0.00           H  
HETATM   31  H   UNL     1       5.119  -1.641   1.709  1.00  0.00           H  
HETATM   32  H   UNL     1       4.201  -1.552   0.174  1.00  0.00           H  
HETATM   33  H   UNL     1       3.362   0.959  -0.414  1.00  0.00           H  
HETATM   34  H   UNL     1       3.848   2.165   0.817  1.00  0.00           H  
HETATM   35  H   UNL     1       7.171  -1.018   0.733  1.00  0.00           H  
HETATM   36  H   UNL     1       8.737  -0.918  -1.191  1.00  0.00           H  
HETATM   37  H   UNL     1       8.163   0.538  -3.122  1.00  0.00           H  
HETATM   38  H   UNL     1       6.073   1.834  -3.078  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.832   2.958   0.179  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.153  -1.044  -1.110  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.653   3.036   1.270  1.00  0.00           H  
HETATM   42  H   UNL     1       0.152   0.664   2.759  1.00  0.00           H  
HETATM   43  H   UNL     1       0.466  -1.008   2.233  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.123  -2.831  -1.378  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.445  -3.636  -2.256  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.160  -1.894  -2.480  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.786  -3.299   1.110  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.492  -4.433  -0.230  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.120  -3.754   0.679  1.00  0.00           H  
HETATM   50  H   UNL     1       0.969   1.505   0.574  1.00  0.00           H  
HETATM   51  H   UNL     1       1.283  -0.166   0.048  1.00  0.00           H  
CONECT    1    2    5   27   28                                       
CONECT    2    1    3   29   30                                       
CONECT    3    2    4   31   32                                       
CONECT    4    3    5    6                                            
CONECT    5    1    4   33   34                                       
CONECT    6    4    7    7   11                                       
CONECT    7    6    6    8   35                                       
CONECT    8    7    9    9   36                                       
CONECT    9    8    8   10   37                                       
CONECT   10    9   11   11   38                                       
CONECT   11    6   10   10                                            
CONECT   12   13   13   15   39                                       
CONECT   13   12   12   14   22                                       
CONECT   14   13   17   17   40                                       
CONECT   15   12   16   16   41                                       
CONECT   16   15   15   17   21                                       
CONECT   17   14   14   16   18                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   21   24                                       
CONECT   21   16   20   20                                            
CONECT   22   13                                                      
CONECT   23   18   25   26                                            
CONECT   24   20   27   42   43                                       
CONECT   25   23   44   45   46                                       
CONECT   26   23   47   48   49                                       
CONECT   27    1   24   50   51                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
