COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.006  -0.195  -0.235  1.00  0.00           N  
HETATM    2  N   UNL     1       3.246   2.343   2.165  1.00  0.00           N  
HETATM    3  C   UNL     1      -5.105   1.533   0.613  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.175  -0.180  -1.450  1.00  0.00           C  
HETATM    5  C   UNL     1       0.098  -0.972  -1.158  1.00  0.00           C  
HETATM    6  C   UNL     1       0.984  -0.166  -0.243  1.00  0.00           C  
HETATM    7  C   UNL     1       2.814   1.314   0.085  1.00  0.00           C  
HETATM    8  C   UNL     1       4.479   2.651   1.836  1.00  0.00           C  
HETATM    9  C   UNL     1       6.725   2.252  -1.060  1.00  0.00           C  
HETATM   10  C   UNL     1       4.609   1.259  -1.600  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.228  -2.287  -0.500  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.694  -4.749   0.692  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.651  -3.756   0.743  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.422  -2.525   0.144  1.00  0.00           C  
HETATM   15 CL   UNL     1       1.710  -5.760  -0.038  1.00  0.00          Cl  
HETATM   16  C   UNL     1       0.502  -4.515   0.038  1.00  0.00           C  
HETATM   17  C   UNL     1       0.733  -3.289  -0.553  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.520  -1.493   0.215  1.00  0.00           C  
HETATM   19  S   UNL     1      -2.343   1.198   0.595  1.00  0.00           S  
HETATM   20  O   UNL     1      -2.576   0.815   1.944  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.350   2.141   0.216  1.00  0.00           O  
HETATM   22  N   UNL     1      -3.783   1.778   0.018  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.951   2.623  -1.178  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.410   2.375  -1.637  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.146   2.244  -0.278  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.406   1.388  -0.425  1.00  0.00           C  
HETATM   27  O   UNL     1       0.845  -0.243   0.959  1.00  0.00           O  
HETATM   28  N   UNL     1       1.932   0.640  -0.761  1.00  0.00           N  
HETATM   29  C   UNL     1       4.129   1.615  -0.333  1.00  0.00           C  
HETATM   30  C   UNL     1       5.888   1.577  -1.946  1.00  0.00           C  
HETATM   31  C   UNL     1       6.292   2.614   0.179  1.00  0.00           C  
HETATM   32  C   UNL     1       4.980   2.302   0.571  1.00  0.00           C  
HETATM   33  C   UNL     1       2.422   1.702   1.349  1.00  0.00           C  
HETATM   34  H   UNL     1      -5.308   0.462   0.638  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.139   1.943   1.622  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.718  -0.644  -2.273  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.919   0.847  -1.709  1.00  0.00           H  
HETATM   38  H   UNL     1       0.626  -1.160  -2.093  1.00  0.00           H  
HETATM   39  H   UNL     1       5.109   3.175   2.539  1.00  0.00           H  
HETATM   40  H   UNL     1       7.735   2.491  -1.360  1.00  0.00           H  
HETATM   41  H   UNL     1       3.971   0.736  -2.296  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.879  -5.705   1.160  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.585  -3.938   1.253  1.00  0.00           H  
HETATM   44  H   UNL     1       1.668  -3.108  -1.063  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.872  -1.408   1.243  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.346  -1.798  -0.427  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.807   3.673  -0.923  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.250   2.323  -1.957  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.790   3.222  -2.207  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.486   1.453  -2.214  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.393   3.225   0.127  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.846   1.217   0.558  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.125   1.907  -1.059  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.145   0.432  -0.878  1.00  0.00           H  
HETATM   55  H   UNL     1       2.001   0.752  -1.722  1.00  0.00           H  
HETATM   56  H   UNL     1       6.259   1.302  -2.923  1.00  0.00           H  
HETATM   57  H   UNL     1       6.952   3.136   0.856  1.00  0.00           H  
HETATM   58  H   UNL     1       1.420   1.478   1.682  1.00  0.00           H  
CONECT    1    4   19   18                                            
CONECT    2    8   33   33                                            
CONECT    3   25   22   34   35                                       
CONECT    4    5    1   36   37                                       
CONECT    5    6    4   11   38                                       
CONECT    6   28    5   27   27                                       
CONECT    7   29   29   33   28                                       
CONECT    8   32   32    2   39                                       
CONECT    9   31   31   30   40                                       
CONECT   10   30   30   29   41                                       
CONECT   11    5   17   17   14                                       
CONECT   12   16   16   13   42                                       
CONECT   13   14   14   12   43                                       
CONECT   14   11   18   13   13                                       
CONECT   15   16                                                      
CONECT   16   17   15   12   12                                       
CONECT   17   11   11   16   44                                       
CONECT   18    1   14   45   46                                       
CONECT   19   21   21    1   20                                       
CONECT   19   20   22                                                 
CONECT   20   19   19                                                 
CONECT   21   19   19                                                 
CONECT   22   19    3   23                                            
CONECT   23   22   24   47   48                                       
CONECT   24   25   23   49   50                                       
CONECT   25    3   26   24   51                                       
CONECT   26   25   52   53   54                                       
CONECT   27    6    6                                                 
CONECT   28    7    6   55                                            
CONECT   29   32   10    7    7                                       
CONECT   30    9   10   10   56                                       
CONECT   31    9    9   32   57                                       
CONECT   32   31    8    8   29                                       
CONECT   33    2    2    7   58                                       
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   28                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
