COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.970   2.269   0.223  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.953  -2.973   0.171  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.829  -2.032   0.646  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.366   0.438  -0.005  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.584  -2.229  -0.221  1.00  0.00           C  
HETATM    6  O   UNL     1      -3.338  -3.862   1.222  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.775   2.049  -0.586  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.757  -0.745   0.609  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.120  -2.023  -0.190  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.601   2.224  -1.238  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.772   1.279  -0.898  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.795   1.185   0.956  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.639   0.901   0.212  1.00  0.00           C  
HETATM   14  N   UNL     1       5.723  -0.361  -0.834  1.00  0.00           N  
HETATM   15  O   UNL     1      -5.370  -2.559   0.248  1.00  0.00           O  
HETATM   16  O   UNL     1      -2.313  -0.685   0.512  1.00  0.00           O  
HETATM   17  N   UNL     1      -6.665   0.509   0.960  1.00  0.00           N  
HETATM   18  C   UNL     1      -7.001   2.736  -0.557  1.00  0.00           C  
HETATM   19  N   UNL     1      -7.194   3.873  -1.322  1.00  0.00           N  
HETATM   20  S   UNL     1       0.777  -1.227   0.437  1.00  0.00           S  
HETATM   21  C   UNL     1       2.140  -1.588  -0.705  1.00  0.00           C  
HETATM   22  C   UNL     1       3.383  -0.805  -0.279  1.00  0.00           C  
HETATM   23  C   UNL     1       4.532  -1.110  -1.242  1.00  0.00           C  
HETATM   24  C   UNL     1       6.889  -0.476  -1.554  1.00  0.00           C  
HETATM   25  N   UNL     1       6.934  -1.252  -2.600  1.00  0.00           N  
HETATM   26  N   UNL     1       8.007   0.229  -1.171  1.00  0.00           N  
HETATM   27  C   UNL     1       7.998   0.963   0.019  1.00  0.00           C  
HETATM   28  C   UNL     1       7.404   0.435   1.158  1.00  0.00           C  
HETATM   29  C   UNL     1       7.396   1.163   2.332  1.00  0.00           C  
HETATM   30  C   UNL     1       7.978   2.417   2.374  1.00  0.00           C  
HETATM   31  C   UNL     1       8.570   2.945   1.241  1.00  0.00           C  
HETATM   32  C   UNL     1       8.586   2.220   0.066  1.00  0.00           C  
HETATM   33  H   UNL     1      -2.634  -3.536  -0.706  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.589  -2.237   1.689  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.298  -3.281  -0.212  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.801  -1.920  -1.244  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.062  -4.458   0.987  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.070  -0.840   1.648  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.139  -1.820  -1.260  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.763   1.177  -1.269  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.609   0.839   1.576  1.00  0.00           H  
HETATM   42  H   UNL     1       5.690   0.217  -0.055  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.641  -3.360  -0.222  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.478   4.204  -1.887  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.044   4.339  -1.293  1.00  0.00           H  
HETATM   46  H   UNL     1       2.358  -2.656  -0.683  1.00  0.00           H  
HETATM   47  H   UNL     1       1.855  -1.295  -1.715  1.00  0.00           H  
HETATM   48  H   UNL     1       3.165   0.263  -0.300  1.00  0.00           H  
HETATM   49  H   UNL     1       3.668  -1.098   0.732  1.00  0.00           H  
HETATM   50  H   UNL     1       4.247  -0.817  -2.252  1.00  0.00           H  
HETATM   51  H   UNL     1       4.751  -2.178  -1.220  1.00  0.00           H  
HETATM   52  H   UNL     1       7.731  -1.276  -3.153  1.00  0.00           H  
HETATM   53  H   UNL     1       8.803   0.215  -1.727  1.00  0.00           H  
HETATM   54  H   UNL     1       6.949  -0.544   1.126  1.00  0.00           H  
HETATM   55  H   UNL     1       6.935   0.753   3.218  1.00  0.00           H  
HETATM   56  H   UNL     1       7.970   2.984   3.293  1.00  0.00           H  
HETATM   57  H   UNL     1       9.024   3.925   1.277  1.00  0.00           H  
HETATM   58  H   UNL     1       9.053   2.632  -0.817  1.00  0.00           H  
CONECT    1   18   12   12                                            
CONECT    2    3    9    6   33                                       
CONECT    3   16    5    2   34                                       
CONECT    4   11   13    8                                            
CONECT    5   20    3   35   36                                       
CONECT    6    2   37                                                 
CONECT    7   10   18   18   13                                       
CONECT    8    4   16    9   38                                       
CONECT    9    8    2   15   39                                       
CONECT   10    7   11   11                                            
CONECT   11   10   10    4   40                                       
CONECT   12    1    1   17   41                                       
CONECT   13    7    4   17   17                                       
CONECT   14   23   24   42                                            
CONECT   15    9   43                                                 
CONECT   16    8    3                                                 
CONECT   17   13   13   12                                            
CONECT   18   19    7    7    1                                       
CONECT   19   18   44   45                                            
CONECT   20   21    5                                                 
CONECT   21   22   20   46   47                                       
CONECT   22   23   21   48   49                                       
CONECT   23   14   22   50   51                                       
CONECT   24   14   26   25   25                                       
CONECT   25   24   24   52                                            
CONECT   26   24   27   53                                            
CONECT   27   28   26   32   32                                       
CONECT   28   29   29   27   54                                       
CONECT   29   28   28   30   55                                       
CONECT   30   29   31   31   56                                       
CONECT   31   30   30   32   57                                       
CONECT   32   27   27   31   58                                       
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
