COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.011   2.585  -0.418  1.00  0.00           C  
HETATM    2  CA  UNL     1      -6.389   1.116  -0.615  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.736   0.302   0.413  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.473  -0.132   0.229  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.802  -0.969   1.287  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.576  -2.423  -0.117  1.00  0.00           C  
HETATM    7  C   UNL     1       0.332  -3.236  -0.758  1.00  0.00           C  
HETATM    8  C   UNL     1       1.671  -2.892  -0.789  1.00  0.00           C  
HETATM    9  C   UNL     1       2.106  -1.720  -0.170  1.00  0.00           C  
HETATM   10  C   UNL     1       1.193  -0.895   0.479  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.157  -1.241   0.502  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.339  -0.586   1.095  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.316   0.459   1.715  1.00  0.00           O  
HETATM   14  C   UNL     1       6.967   1.965  -0.394  1.00  0.00           C  
HETATM   15  C   UNL     1       7.115   3.329  -1.074  1.00  0.00           C  
HETATM   16  C   UNL     1       8.585   3.757  -1.028  1.00  0.00           C  
HETATM   17  C   UNL     1       8.956   2.534   1.002  1.00  0.00           C  
HETATM   18  C   UNL     1       7.502   2.057   1.038  1.00  0.00           C  
HETATM   19  C   UNL     1     -10.626   0.679  -0.300  1.00  0.00           C  
HETATM   20  C   UNL     1     -10.027   0.729  -1.544  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.656   0.869  -1.647  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.541   3.050   0.825  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.877   0.152  -0.789  1.00  0.00           O  
HETATM   24  N   UNL     1      -2.445  -1.311   0.851  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.067  -2.509   0.094  1.00  0.00           C  
HETATM   26  C   UNL     1       3.543  -1.357  -0.199  1.00  0.00           C  
HETATM   27  N   UNL     1       3.917  -0.081  -0.268  1.00  0.00           N  
HETATM   28  C   UNL     1       5.199   0.245  -0.293  1.00  0.00           C  
HETATM   29  N   UNL     1       5.553   1.582  -0.366  1.00  0.00           N  
HETATM   30  O   UNL     1       9.027   3.795   0.330  1.00  0.00           O  
HETATM   31  N   UNL     1       6.153  -0.674  -0.250  1.00  0.00           N  
HETATM   32  C   UNL     1       5.856  -1.961  -0.179  1.00  0.00           C  
HETATM   33  C   UNL     1       4.527  -2.349  -0.146  1.00  0.00           C  
HETATM   34 CL   UNL     1       4.093  -4.027  -0.047  1.00  0.00          Cl  
HETATM   35  C   UNL     1      -7.883   0.962  -0.504  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.482   0.912   0.741  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.854   0.777   0.843  1.00  0.00           C  
HETATM   38  H1  UNL     1      -4.925   2.684  -0.410  1.00  0.00           H  
HETATM   39  H2  UNL     1      -6.424   3.179  -1.234  1.00  0.00           H  
HETATM   40  HA  UNL     1      -6.062   0.786  -1.601  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.212   0.075   1.227  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.753  -0.407   2.219  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.374  -1.884   1.443  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.002  -4.144  -1.237  1.00  0.00           H  
HETATM   45  H   UNL     1       2.380  -3.532  -1.293  1.00  0.00           H  
HETATM   46  H   UNL     1       1.528   0.013   0.958  1.00  0.00           H  
HETATM   47  H   UNL     1       7.536   1.218  -0.948  1.00  0.00           H  
HETATM   48  H   UNL     1       6.789   3.257  -2.111  1.00  0.00           H  
HETATM   49  H   UNL     1       6.505   4.065  -0.550  1.00  0.00           H  
HETATM   50  H   UNL     1       9.189   3.042  -1.587  1.00  0.00           H  
HETATM   51  H   UNL     1       8.689   4.747  -1.473  1.00  0.00           H  
HETATM   52  H   UNL     1       9.329   2.643   2.021  1.00  0.00           H  
HETATM   53  H   UNL     1       9.565   1.804   0.469  1.00  0.00           H  
HETATM   54  H   UNL     1       6.900   2.767   1.606  1.00  0.00           H  
HETATM   55  H   UNL     1       7.451   1.077   1.511  1.00  0.00           H  
HETATM   56  H   UNL     1     -11.697   0.569  -0.220  1.00  0.00           H  
HETATM   57  H   UNL     1     -10.630   0.657  -2.437  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.188   0.908  -2.619  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.340   3.977   1.016  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.582  -2.511  -0.867  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.315  -3.411   0.653  1.00  0.00           H  
HETATM   62  H   UNL     1       4.865   2.265  -0.398  1.00  0.00           H  
HETATM   63  H   UNL     1       6.642  -2.702  -0.145  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.879   0.988   1.634  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.322   0.738   1.816  1.00  0.00           H  
CONECT    1   22    2   38   39                                       
CONECT    2    3    1   35   40                                       
CONECT    3    4    2   41                                            
CONECT    4    5    3   23   23                                       
CONECT    5   24    4   42   43                                       
CONECT    6   11   11    7   25                                       
CONECT    7    8    8    6   44                                       
CONECT    8    9    7    7   45                                       
CONECT    9   26   10   10    8                                       
CONECT   10    9    9   11   46                                       
CONECT   11   10   12    6    6                                       
CONECT   12   11   13   13   24                                       
CONECT   13   12   12                                                 
CONECT   14   18   15   29   47                                       
CONECT   15   16   14   48   49                                       
CONECT   16   30   15   50   51                                       
CONECT   17   30   18   52   53                                       
CONECT   18   17   14   54   55                                       
CONECT   19   37   20   20   56                                       
CONECT   20   19   19   21   57                                       
CONECT   21   35   35   20   58                                       
CONECT   22    1   59                                                 
CONECT   23    4    4                                                 
CONECT   24   12   25    5                                            
CONECT   25    6   24   60   61                                       
CONECT   26   27    9   33   33                                       
CONECT   27   28   28   26                                            
CONECT   28   29   27   27   31                                       
CONECT   29   14   28   62                                            
CONECT   30   17   16                                                 
CONECT   31   28   32   32                                            
CONECT   32   31   31   33   63                                       
CONECT   33   26   26   32   34                                       
CONECT   34   33                                                      
CONECT   35   36    2   21   21                                       
CONECT   36   37   37   35   64                                       
CONECT   37   36   36   19   65                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   29                                                      
CONECT   63   32                                                      
CONECT   64   36                                                      
CONECT   65   37                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
