COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.926  -3.899   1.138  1.00  0.00           C  
HETATM    2  C   UNL     1       1.129  -3.977  -0.722  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.942  -0.025   0.571  1.00  0.00           C  
HETATM    4  C   UNL     1       1.308   1.591  -1.631  1.00  0.00           C  
HETATM    5  C   UNL     1       1.707   2.650  -3.827  1.00  0.00           C  
HETATM    6  C   UNL     1       1.942   0.575  -2.603  1.00  0.00           C  
HETATM    7  C   UNL     1       1.693   1.686   0.841  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.044   1.102  -1.180  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.395  -0.510  -0.077  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.557   0.216   0.037  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.570  -0.658   0.398  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.789  -2.877   0.208  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.038  -4.957   1.137  1.00  0.00           C  
HETATM   14  C   UNL     1       0.991  -4.998   0.207  1.00  0.00           C  
HETATM   15  C   UNL     1       0.241  -2.919  -0.722  1.00  0.00           C  
HETATM   16  C   UNL     1       2.900  -6.017  -0.778  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.978   1.668  -0.127  1.00  0.00           C  
HETATM   18  C   UNL     1       1.159   2.910  -2.408  1.00  0.00           C  
HETATM   19  C   UNL     1       1.579   1.117  -4.008  1.00  0.00           C  
HETATM   20  C   UNL     1       2.207   1.794  -0.438  1.00  0.00           C  
HETATM   21  C   UNL     1       2.517   1.872   1.935  1.00  0.00           C  
HETATM   22  C   UNL     1       3.857   2.160   1.750  1.00  0.00           C  
HETATM   23  C   UNL     1       4.372   2.263   0.470  1.00  0.00           C  
HETATM   24  C   UNL     1       3.545   2.087  -0.623  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.140  -0.008  -0.422  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.055  -1.873   0.502  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.691  -1.803   0.208  1.00  0.00           N  
HETATM   28  O   UNL     1      -1.045   1.707  -1.500  1.00  0.00           O  
HETATM   29  O   UNL     1       1.865  -6.039   0.207  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.360   2.070   2.123  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.508   2.520  -0.011  1.00  0.00           O  
HETATM   32  S   UNL     1      -4.581   1.761   0.753  1.00  0.00           S  
HETATM   33 CL   UNL     1       4.893   2.394   3.124  1.00  0.00          Cl  
HETATM   34  H   UNL     1      -1.725  -3.865   1.864  1.00  0.00           H  
HETATM   35  H   UNL     1       1.930  -4.009  -1.445  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.560  -0.203  -0.310  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.432  -0.412   1.465  1.00  0.00           H  
HETATM   38  H   UNL     1       1.106   3.174  -4.570  1.00  0.00           H  
HETATM   39  H   UNL     1       2.751   2.959  -3.895  1.00  0.00           H  
HETATM   40  H   UNL     1       3.024   0.546  -2.474  1.00  0.00           H  
HETATM   41  H   UNL     1       1.512  -0.415  -2.454  1.00  0.00           H  
HETATM   42  H   UNL     1       0.647   1.461   0.985  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.145  -5.752   1.860  1.00  0.00           H  
HETATM   44  H   UNL     1       0.349  -2.124  -1.445  1.00  0.00           H  
HETATM   45  H   UNL     1       2.455  -6.007  -1.773  1.00  0.00           H  
HETATM   46  H   UNL     1       3.510  -5.123  -0.644  1.00  0.00           H  
HETATM   47  H   UNL     1       3.525  -6.903  -0.668  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.248   2.332   0.335  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.103   1.912  -1.182  1.00  0.00           H  
HETATM   50  H   UNL     1       0.109   3.196  -2.461  1.00  0.00           H  
HETATM   51  H   UNL     1       1.737   3.697  -1.923  1.00  0.00           H  
HETATM   52  H   UNL     1       0.558   0.844  -4.276  1.00  0.00           H  
HETATM   53  H   UNL     1       2.286   0.757  -4.756  1.00  0.00           H  
HETATM   54  H   UNL     1       2.115   1.791   2.934  1.00  0.00           H  
HETATM   55  H   UNL     1       5.419   2.488   0.325  1.00  0.00           H  
HETATM   56  H   UNL     1       3.946   2.171  -1.623  1.00  0.00           H  
HETATM   57  H   UNL     1       0.663  -0.458  -0.116  1.00  0.00           H  
CONECT    1   13   13   12   34                                       
CONECT    2   14   14   15   35                                       
CONECT    3   32   11   36   37                                       
CONECT    4    6    8   18   20                                       
CONECT    5   19   18   38   39                                       
CONECT    6   19    4   40   41                                       
CONECT    7   20   21   21   42                                       
CONECT    8   25   28   28    4                                       
CONECT    9   10   10   25   27                                       
CONECT   10   17   11    9    9                                       
CONECT   11    3   10   26   26                                       
CONECT   12    1   27   15   15                                       
CONECT   13    1    1   14   43                                       
CONECT   14   13   29    2    2                                       
CONECT   15   12   12    2   44                                       
CONECT   16   29   45   46   47                                       
CONECT   17   32   10   48   49                                       
CONECT   18    4    5   50   51                                       
CONECT   19    6    5   52   53                                       
CONECT   20    4   24   24    7                                       
CONECT   21    7    7   22   54                                       
CONECT   22   23   23   21   33                                       
CONECT   23   24   22   22   55                                       
CONECT   24   20   20   23   56                                       
CONECT   25    9    8   57                                            
CONECT   26   11   11   27                                            
CONECT   27    9   26   12                                            
CONECT   28    8    8                                                 
CONECT   29   14   16                                                 
CONECT   30   32   32                                                 
CONECT   31   32   32                                                 
CONECT   32   31   31   30   30                                       
CONECT   32   17    3                                                 
CONECT   33   22                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
