COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.699   0.435  -0.927  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.926  -0.185  -0.804  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.061  -1.258   0.073  1.00  0.00           C  
HETATM    4  N   UNL     1      -7.293  -1.887   0.203  1.00  0.00           N  
HETATM    5  N   UNL     1      -5.029  -1.687   0.784  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.842  -1.122   0.695  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.631  -0.044  -0.160  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.290   0.584  -0.262  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.233   0.094   0.503  1.00  0.00           C  
HETATM   10  C   UNL     1       0.014   0.683   0.405  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.090   1.659  -1.127  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.846   2.253  -1.217  1.00  0.00           C  
HETATM   13  C   UNL     1       0.199   1.779  -0.447  1.00  0.00           C  
HETATM   14  N   UNL     1       1.467   2.375  -0.459  1.00  0.00           N  
HETATM   15  C   UNL     1       2.244   2.773  -1.488  1.00  0.00           C  
HETATM   16  C   UNL     1       1.910   2.677  -2.955  1.00  0.00           C  
HETATM   17  N   UNL     1       3.342   3.261  -0.968  1.00  0.00           N  
HETATM   18  N   UNL     1       3.290   3.190   0.318  1.00  0.00           N  
HETATM   19  C   UNL     1       2.163   2.658   0.683  1.00  0.00           C  
HETATM   20  C   UNL     1       1.650   2.383   2.070  1.00  0.00           C  
HETATM   21  C   UNL     1       0.236   2.950   2.213  1.00  0.00           C  
HETATM   22  C   UNL     1       1.620   0.866   2.318  1.00  0.00           C  
HETATM   23  N   UNL     1       1.110   0.196   1.115  1.00  0.00           N  
HETATM   24  C   UNL     1       1.743  -0.966   0.668  1.00  0.00           C  
HETATM   25  C   UNL     1       2.759  -1.540   1.422  1.00  0.00           C  
HETATM   26  C   UNL     1       3.383  -2.689   0.978  1.00  0.00           C  
HETATM   27  C   UNL     1       2.997  -3.269  -0.218  1.00  0.00           C  
HETATM   28 CL   UNL     1       3.788  -4.709  -0.777  1.00  0.00          Cl  
HETATM   29  C   UNL     1       1.986  -2.700  -0.972  1.00  0.00           C  
HETATM   30  C   UNL     1       1.354  -1.554  -0.530  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.565   1.267  -1.603  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.773   0.159  -1.380  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.052  -1.578  -0.315  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.393  -2.635   0.812  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.024  -1.500   1.290  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.387  -0.742   1.169  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.909   2.029  -1.727  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.690   3.086  -1.887  1.00  0.00           H  
HETATM   39  H   UNL     1       1.399   3.586  -3.272  1.00  0.00           H  
HETATM   40  H   UNL     1       2.829   2.557  -3.529  1.00  0.00           H  
HETATM   41  H   UNL     1       1.261   1.817  -3.124  1.00  0.00           H  
HETATM   42  H   UNL     1       2.306   2.857   2.801  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.420   2.477   1.482  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.136   2.751   3.218  1.00  0.00           H  
HETATM   45  H   UNL     1       0.257   4.026   2.040  1.00  0.00           H  
HETATM   46  H   UNL     1       2.629   0.512   2.533  1.00  0.00           H  
HETATM   47  H   UNL     1       0.969   0.647   3.164  1.00  0.00           H  
HETATM   48  H   UNL     1       3.060  -1.088   2.355  1.00  0.00           H  
HETATM   49  H   UNL     1       4.173  -3.135   1.564  1.00  0.00           H  
HETATM   50  H   UNL     1       1.687  -3.154  -1.905  1.00  0.00           H  
HETATM   51  H   UNL     1       0.565  -1.110  -1.118  1.00  0.00           H  
CONECT    1    2    7    7   31                                       
CONECT    2    3    3    1   32                                       
CONECT    3    4    2    2    5                                       
CONECT    4    3   33   34                                            
CONECT    5    3    6    6                                            
CONECT    6    5    5    7   35                                       
CONECT    7    1    1    6    8                                       
CONECT    8    7    9    9   11                                       
CONECT    9    8    8   10   36                                       
CONECT   10    9   23   13   13                                       
CONECT   11    8   12   12   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   10   10   12   14                                       
CONECT   14   13   19   15                                            
CONECT   15   14   16   17   17                                       
CONECT   16   15   39   40   41                                       
CONECT   17   18   15   15                                            
CONECT   18   19   19   17                                            
CONECT   19   20   14   18   18                                       
CONECT   20   22   21   19   42                                       
CONECT   21   20   43   44   45                                       
CONECT   22   23   20   46   47                                       
CONECT   23   24   22   10                                            
CONECT   24   30   30   25   23                                       
CONECT   25   26   26   24   48                                       
CONECT   26   27   25   25   49                                       
CONECT   27   28   29   29   26                                       
CONECT   28   27                                                      
CONECT   29   27   27   30   50                                       
CONECT   30   29   24   24   51                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
