COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.892  -0.922  -0.857  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.503  -0.643   0.471  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.483  -0.656   1.474  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.730  -0.928   1.137  1.00  0.00           N  
HETATM    5  N   UNL     1      -2.170  -1.186  -1.105  1.00  0.00           N  
HETATM    6  C   UNL     1       6.831   3.007   0.495  1.00  0.00           C  
HETATM    7  O   UNL     1       5.447   2.799   0.206  1.00  0.00           O  
HETATM    8  C   UNL     1       4.991   1.519   0.256  1.00  0.00           C  
HETATM    9  C   UNL     1       3.659   1.248  -0.014  1.00  0.00           C  
HETATM   10 CL   UNL     1       2.573   2.540  -0.417  1.00  0.00          Cl  
HETATM   11  C   UNL     1       5.861   0.486   0.573  1.00  0.00           C  
HETATM   12  C   UNL     1       5.402  -0.821   0.626  1.00  0.00           C  
HETATM   13  O   UNL     1       6.259  -1.830   0.936  1.00  0.00           O  
HETATM   14  C   UNL     1       7.617  -1.470   1.196  1.00  0.00           C  
HETATM   15  C   UNL     1       4.070  -1.101   0.362  1.00  0.00           C  
HETATM   16 CL   UNL     1       3.496  -2.738   0.429  1.00  0.00          Cl  
HETATM   17  C   UNL     1       3.193  -0.066   0.039  1.00  0.00           C  
HETATM   18  C   UNL     1       1.768  -0.360  -0.243  1.00  0.00           C  
HETATM   19  C   UNL     1       0.849  -0.359   0.771  1.00  0.00           C  
HETATM   20  C   UNL     1       1.332  -0.658  -1.609  1.00  0.00           C  
HETATM   21  O   UNL     1       2.144  -0.664  -2.517  1.00  0.00           O  
HETATM   22  N   UNL     1       0.037  -0.926  -1.866  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.383  -1.222  -3.238  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.060  -1.185  -0.124  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.379  -1.464  -0.422  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.385  -1.472   0.643  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.612  -2.310   0.222  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.747  -1.600   0.762  1.00  0.00           O  
HETATM   29  C   UNL     1      -7.461  -0.201   0.542  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.956  -0.052   0.858  1.00  0.00           C  
HETATM   31  N   UNL     1      -5.330   0.898  -0.064  1.00  0.00           N  
HETATM   32  C   UNL     1      -5.234   2.200   0.272  1.00  0.00           C  
HETATM   33  O   UNL     1      -5.668   2.586   1.340  1.00  0.00           O  
HETATM   34  C   UNL     1      -4.606   3.155  -0.654  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.512   4.439  -0.323  1.00  0.00           C  
HETATM   36  H   UNL     1      -1.223  -0.447   2.502  1.00  0.00           H  
HETATM   37  H   UNL     1       7.047   2.659   1.505  1.00  0.00           H  
HETATM   38  H   UNL     1       7.439   2.451  -0.219  1.00  0.00           H  
HETATM   39  H   UNL     1       7.062   4.069   0.419  1.00  0.00           H  
HETATM   40  H   UNL     1       6.900   0.701   0.779  1.00  0.00           H  
HETATM   41  H   UNL     1       8.040  -0.988   0.315  1.00  0.00           H  
HETATM   42  H   UNL     1       7.656  -0.783   2.041  1.00  0.00           H  
HETATM   43  H   UNL     1       8.192  -2.367   1.431  1.00  0.00           H  
HETATM   44  H   UNL     1       1.152  -0.145   1.785  1.00  0.00           H  
HETATM   45  H   UNL     1       0.481  -1.180  -3.900  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.821  -2.220  -3.276  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.123  -0.488  -3.558  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.639  -1.655  -1.337  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.956  -1.855   1.569  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.680  -2.365  -0.864  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.552  -3.311   0.650  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.659   0.068  -0.496  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.053   0.418   1.215  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.812   0.265   1.891  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.984   0.591  -0.917  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.220   2.812  -1.603  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.050   5.140  -1.002  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.897   4.781   0.627  1.00  0.00           H  
CONECT    1   22    2    5    5                                       
CONECT    2   19    1    3    3                                       
CONECT    3    2    2    4   36                                       
CONECT    4    3   24   24                                            
CONECT    5    1    1   24                                            
CONECT    6    7   37   38   39                                       
CONECT    7    6    8                                                 
CONECT    8   11    7    9    9                                       
CONECT    9    8    8   17   10                                       
CONECT   10    9                                                      
CONECT   11   12   12    8   40                                       
CONECT   12   13   11   11   15                                       
CONECT   13   14   12                                                 
CONECT   14   13   41   42   43                                       
CONECT   15   12   16   17   17                                       
CONECT   16   15                                                      
CONECT   17   15   15    9   18                                       
CONECT   18   17   20   19   19                                       
CONECT   19   18   18    2   44                                       
CONECT   20   21   21   18   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23    1                                            
CONECT   23   22   45   46   47                                       
CONECT   24    5    4    4   25                                       
CONECT   25   24   26   48                                            
CONECT   26   27   25   30   49                                       
CONECT   27   28   26   50   51                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   52   53                                       
CONECT   30   26   29   31   54                                       
CONECT   31   30   32   55                                            
CONECT   32   31   33   33   34                                       
CONECT   33   32   32                                                 
CONECT   34   32   35   35   56                                       
CONECT   35   34   34   57   58                                       
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40   11                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   19                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   34                                                      
CONECT   57   35                                                      
CONECT   58   35                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
