COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.691  -2.595   0.313  1.00  0.00           C  
HETATM    2  C   UNL     1       0.124  -3.725   0.206  1.00  0.00           C  
HETATM    3  N   UNL     1       1.381  -1.982   0.666  1.00  0.00           N  
HETATM    4  N   UNL     1       1.363  -3.361   0.417  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.344  -5.125  -0.099  1.00  0.00           C  
HETATM    6  C   UNL     1       0.108  -1.530   0.598  1.00  0.00           C  
HETATM    7  C   UNL     1       2.569  -1.173   0.951  1.00  0.00           C  
HETATM    8  C   UNL     1       3.139  -0.646  -0.341  1.00  0.00           C  
HETATM    9  N   UNL     1       4.242   0.128  -0.325  1.00  0.00           N  
HETATM   10  O   UNL     1       2.606  -0.920  -1.395  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.617   0.100   0.688  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.021   1.373   0.869  1.00  0.00           N  
HETATM   13  O   UNL     1      -2.432  -0.767   0.438  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.360   1.718   0.659  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.949   2.715   1.446  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.248   3.071   1.264  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.018   2.434   0.275  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.429   1.424  -0.527  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.083   1.078  -0.322  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.309  -0.213   0.785  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.695  -5.232  -1.584  1.00  0.00           C  
HETATM   22  C   UNL     1       0.770  -6.119   0.235  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.582  -5.443   0.742  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.363   2.781   0.065  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.081   2.145  -0.901  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.502   1.152  -1.689  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.202   0.789  -1.515  1.00  0.00           C  
HETATM   28  C   UNL     1       4.790   0.637  -1.584  1.00  0.00           C  
HETATM   29  C   UNL     1       4.690   2.165  -1.605  1.00  0.00           C  
HETATM   30  S   UNL     1       5.595   2.835  -0.179  1.00  0.00           S  
HETATM   31  C   UNL     1       4.790   1.964   1.197  1.00  0.00           C  
HETATM   32  C   UNL     1       4.877   0.459   0.952  1.00  0.00           C  
HETATM   33  O   UNL     1       5.306   4.222  -0.069  1.00  0.00           O  
HETATM   34  O   UNL     1       6.948   2.409  -0.258  1.00  0.00           O  
HETATM   35  H   UNL     1      -1.763  -2.569   0.188  1.00  0.00           H  
HETATM   36  H   UNL     1       2.294  -0.338   1.594  1.00  0.00           H  
HETATM   37  H   UNL     1       3.316  -1.788   1.453  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.383   2.050   1.144  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.364   3.208   2.207  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.689   3.842   1.879  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.620   0.313  -0.928  1.00  0.00           H  
HETATM   42  H   UNL     1       0.341   0.479   0.985  1.00  0.00           H  
HETATM   43  H   UNL     1       0.187  -5.005  -2.184  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.033  -6.244  -1.806  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.488  -4.523  -1.823  1.00  0.00           H  
HETATM   46  H   UNL     1       1.020  -6.043   1.293  1.00  0.00           H  
HETATM   47  H   UNL     1       0.431  -7.131   0.014  1.00  0.00           H  
HETATM   48  H   UNL     1       1.652  -5.892  -0.364  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.375  -4.735   0.504  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.920  -6.456   0.521  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.332  -5.367   1.800  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.826   3.549   0.668  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.115   2.414  -1.059  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.094   0.663  -2.448  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.766   0.018  -2.133  1.00  0.00           H  
HETATM   56  H   UNL     1       5.835   0.339  -1.671  1.00  0.00           H  
HETATM   57  H   UNL     1       4.224   0.224  -2.419  1.00  0.00           H  
HETATM   58  H   UNL     1       5.129   2.546  -2.527  1.00  0.00           H  
HETATM   59  H   UNL     1       3.644   2.463  -1.546  1.00  0.00           H  
HETATM   60  H   UNL     1       5.295   2.212   2.131  1.00  0.00           H  
HETATM   61  H   UNL     1       3.743   2.262   1.256  1.00  0.00           H  
HETATM   62  H   UNL     1       4.368  -0.068   1.758  1.00  0.00           H  
HETATM   63  H   UNL     1       5.924   0.158   0.925  1.00  0.00           H  
CONECT    1    2    6    6   35                                       
CONECT    2    1    4    4    5                                       
CONECT    3    4    6    7                                            
CONECT    4    2    2    3                                            
CONECT    5    2   21   22   23                                       
CONECT    6    1    1    3   20                                       
CONECT    7    3    8   36   37                                       
CONECT    8    7    9   10   10                                       
CONECT    9    8   28   32                                            
CONECT   10    8    8                                                 
CONECT   11   12   13   13   20                                       
CONECT   12   11   14   38                                            
CONECT   13   11   11                                                 
CONECT   14   12   15   15   19                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15   17   17   40                                       
CONECT   17   16   16   18   24                                       
CONECT   18   17   19   19   27                                       
CONECT   19   14   18   18   41                                       
CONECT   20    6   11   42                                            
CONECT   21    5   43   44   45                                       
CONECT   22    5   46   47   48                                       
CONECT   23    5   49   50   51                                       
CONECT   24   17   25   25   52                                       
CONECT   25   24   24   26   53                                       
CONECT   26   25   27   27   54                                       
CONECT   27   18   26   26   55                                       
CONECT   28    9   29   56   57                                       
CONECT   29   28   30   58   59                                       
CONECT   30   29   31   33   33                                       
CONECT   30   34   34                                                 
CONECT   31   30   32   60   61                                       
CONECT   32    9   31   62   63                                       
CONECT   33   30   30                                                 
CONECT   34   30   30                                                 
CONECT   35    1                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
