COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -6.844   0.204   0.074  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -5.120   0.263   0.266  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.358   1.032  -0.598  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.986   1.079  -0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.376   0.352   0.570  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.898   0.386   0.723  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.377  -0.242   1.850  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.040  -1.492   2.260  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.359  -2.044   3.514  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.942  -2.519   1.130  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.509  -1.200   2.560  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.143  -0.417   1.443  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.516  -0.453   1.284  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.131   0.971  -0.152  1.00  0.00           N  
HETATM   15  C   UNL     1       1.322   0.981   0.037  1.00  0.00           C  
HETATM   16  C   UNL     1       1.995   0.285  -1.148  1.00  0.00           C  
HETATM   17  C   UNL     1       1.605  -1.170  -1.164  1.00  0.00           C  
HETATM   18  C   UNL     1       2.332  -2.149  -0.491  1.00  0.00           C  
HETATM   19  C   UNL     1       1.840  -3.393  -0.614  1.00  0.00           C  
HETATM   20  S   UNL     1       0.396  -3.359  -1.617  1.00  0.00           S  
HETATM   21  C   UNL     1       0.535  -1.618  -1.818  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.415  -0.760  -2.613  1.00  0.00           C  
HETATM   23  C   UNL     1       0.068  -0.671  -4.062  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.896   0.200  -4.869  1.00  0.00           C  
HETATM   25  C   UNL     1       3.554  -1.842   0.298  1.00  0.00           C  
HETATM   26  C   UNL     1       3.808  -2.240   1.577  1.00  0.00           C  
HETATM   27  N   UNL     1       5.019  -1.755   1.923  1.00  0.00           N  
HETATM   28  N   UNL     1       5.530  -1.038   0.833  1.00  0.00           N  
HETATM   29  C   UNL     1       4.661  -1.092  -0.142  1.00  0.00           C  
HETATM   30  C   UNL     1       1.807   2.404   0.126  1.00  0.00           C  
HETATM   31  N   UNL     1       0.904   3.345   0.127  1.00  0.00           N  
HETATM   32  C   UNL     1       1.235   4.645   0.203  1.00  0.00           C  
HETATM   33  C   UNL     1       2.715   4.972   0.288  1.00  0.00           C  
HETATM   34  C   UNL     1       3.657   3.783   0.277  1.00  0.00           C  
HETATM   35  N   UNL     1       3.125   2.597   0.202  1.00  0.00           N  
HETATM   36  O   UNL     1       0.390   5.517   0.203  1.00  0.00           O  
HETATM   37  H   UNL     1      -4.836   1.593  -1.387  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.389   1.677  -1.121  1.00  0.00           H  
HETATM   39  H   UNL     1       0.378   0.122   2.337  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.432  -1.314   4.320  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.850  -2.969   3.817  1.00  0.00           H  
HETATM   42  H   UNL     1       0.691  -2.244   3.300  1.00  0.00           H  
HETATM   43  H   UNL     1       0.107  -2.719   0.911  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.432  -3.443   1.436  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.431  -2.126   0.239  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.043  -2.142   2.685  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.579  -0.625   3.484  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.119  -1.046   1.956  1.00  0.00           H  
HETATM   49  H   UNL     1       1.571   0.453   0.958  1.00  0.00           H  
HETATM   50  H   UNL     1       1.675   0.757  -2.076  1.00  0.00           H  
HETATM   51  H   UNL     1       3.077   0.370  -1.051  1.00  0.00           H  
HETATM   52  H   UNL     1       2.266  -4.279  -0.166  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.411  -1.202  -2.589  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.451   0.240  -2.180  1.00  0.00           H  
HETATM   55  H   UNL     1       1.064  -0.229  -4.086  1.00  0.00           H  
HETATM   56  H   UNL     1       0.104  -1.671  -4.495  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.551   0.263  -5.901  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.892  -0.243  -4.845  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.932   1.199  -4.437  1.00  0.00           H  
HETATM   60  H   UNL     1       3.158  -2.836   2.200  1.00  0.00           H  
HETATM   61  H   UNL     1       5.460  -1.880   2.778  1.00  0.00           H  
HETATM   62  H   UNL     1       4.771  -0.635  -1.114  1.00  0.00           H  
HETATM   63  H   UNL     1       2.970   5.617  -0.554  1.00  0.00           H  
HETATM   64  H   UNL     1       2.888   5.532   1.207  1.00  0.00           H  
HETATM   65  H   UNL     1       4.728   3.914   0.333  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3   13                                       
CONECT    3    2    2    4   37                                       
CONECT    4    3    5    5   38                                       
CONECT    5    4    4   12    6                                       
CONECT    6    5   14   14    7                                       
CONECT    7    6    8   39                                            
CONECT    8   11    7   10    9                                       
CONECT    9    8   40   41   42                                       
CONECT   10    8   43   44   45                                       
CONECT   11   12    8   46   47                                       
CONECT   12   13   13    5   11                                       
CONECT   13    2   12   12   48                                       
CONECT   14    6    6   15                                            
CONECT   15   30   14   16   49                                       
CONECT   16   15   17   50   51                                       
CONECT   17   16   18   21   21                                       
CONECT   18   25   17   19   19                                       
CONECT   19   18   18   20   52                                       
CONECT   20   19   21                                                 
CONECT   21   17   17   22   20                                       
CONECT   22   21   23   53   54                                       
CONECT   23   22   24   55   56                                       
CONECT   24   23   57   58   59                                       
CONECT   25   29   26   26   18                                       
CONECT   26   27   25   25   60                                       
CONECT   27   28   26   61                                            
CONECT   28   27   29   29                                            
CONECT   29   28   28   25   62                                       
CONECT   30   35   31   31   15                                       
CONECT   31   32   30   30                                            
CONECT   32   33   36   36   31                                       
CONECT   33   34   32   63   64                                       
CONECT   34   33   35   35   65                                       
CONECT   35   34   34   30                                            
CONECT   36   32   32                                                 
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   19                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   29                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
