COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -9.172  -2.010   0.658  1.00  0.00           C  
HETATM    2  C   UNL     1     -10.130  -0.303  -0.787  1.00  0.00           C  
HETATM    3  C   UNL     1     -12.425  -2.332   0.385  1.00  0.00           C  
HETATM    4  C   UNL     1       1.913   1.359   0.187  1.00  0.00           C  
HETATM    5  C   UNL     1       2.453   2.478  -0.449  1.00  0.00           C  
HETATM    6  C   UNL     1       4.657   1.744   0.144  1.00  0.00           C  
HETATM    7  C   UNL     1       2.759   0.434   0.802  1.00  0.00           C  
HETATM    8  C   UNL     1       6.869   0.872   0.058  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.474   1.969  -0.337  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.899   0.459   0.478  1.00  0.00           C  
HETATM   11  C   UNL     1       0.449   1.157   0.215  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.286   0.448   0.206  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.314   2.126  -0.996  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.644   0.427  -0.184  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.517  -0.175   0.375  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.055  -1.305   0.753  1.00  0.00           C  
HETATM   17  C   UNL     1      -9.011   0.402  -0.698  1.00  0.00           C  
HETATM   18  C   UNL     1     -11.264  -2.511  -0.596  1.00  0.00           C  
HETATM   19  C   UNL     1       3.818   2.667  -0.469  1.00  0.00           C  
HETATM   20  C   UNL     1       4.124   0.626   0.774  1.00  0.00           C  
HETATM   21  C   UNL     1       9.058  -0.051   0.076  1.00  0.00           C  
HETATM   22  C   UNL     1       9.864  -2.076  -0.073  1.00  0.00           C  
HETATM   23  C   UNL     1       8.685  -1.414  -0.068  1.00  0.00           C  
HETATM   24  C   UNL     1      10.060  -3.565  -0.202  1.00  0.00           C  
HETATM   25  C   UNL     1      10.195  -3.935  -1.681  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.717   1.567  -0.174  1.00  0.00           N  
HETATM   27  N   UNL     1      -3.134  -0.111   0.742  1.00  0.00           N  
HETATM   28  N   UNL     1      -4.227   1.587  -0.483  1.00  0.00           N  
HETATM   29  N   UNL     1      -6.500   1.570  -0.854  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.891  -0.153  -0.044  1.00  0.00           N  
HETATM   31  N   UNL     1     -10.177  -1.598  -0.238  1.00  0.00           N  
HETATM   32  N   UNL     1       6.043   1.935   0.118  1.00  0.00           N  
HETATM   33  N   UNL     1       8.203   1.049   0.138  1.00  0.00           N  
HETATM   34  N   UNL     1      10.363  -0.036   0.145  1.00  0.00           N  
HETATM   35  O   UNL     1      10.824  -1.150   0.062  1.00  0.00           O  
HETATM   36  O   UNL     1       6.412  -0.247  -0.068  1.00  0.00           O  
HETATM   37  S   UNL     1      -0.397  -0.189   0.974  1.00  0.00           S  
HETATM   38  H   UNL     1      -9.310  -2.896   1.259  1.00  0.00           H  
HETATM   39  H   UNL     1     -10.995   0.109  -1.285  1.00  0.00           H  
HETATM   40  H   UNL     1     -12.083  -2.553   1.396  1.00  0.00           H  
HETATM   41  H   UNL     1     -12.784  -1.304   0.339  1.00  0.00           H  
HETATM   42  H   UNL     1     -13.234  -3.012   0.118  1.00  0.00           H  
HETATM   43  H   UNL     1       1.801   3.196  -0.926  1.00  0.00           H  
HETATM   44  H   UNL     1       2.344  -0.431   1.298  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.217   2.876  -0.864  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.231   3.050  -1.548  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.598  -1.102   0.924  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.276  -1.610   1.437  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.957   1.393  -1.122  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.905  -3.540  -0.550  1.00  0.00           H  
HETATM   51  H   UNL     1     -11.606  -2.291  -1.607  1.00  0.00           H  
HETATM   52  H   UNL     1       4.236   3.534  -0.957  1.00  0.00           H  
HETATM   53  H   UNL     1       4.779  -0.090   1.250  1.00  0.00           H  
HETATM   54  H   UNL     1       7.690  -1.826  -0.154  1.00  0.00           H  
HETATM   55  H   UNL     1      10.964  -3.860   0.331  1.00  0.00           H  
HETATM   56  H   UNL     1       9.201  -4.083   0.225  1.00  0.00           H  
HETATM   57  H   UNL     1      10.337  -5.012  -1.774  1.00  0.00           H  
HETATM   58  H   UNL     1       9.291  -3.640  -2.213  1.00  0.00           H  
HETATM   59  H   UNL     1      11.054  -3.417  -2.108  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.194  -0.901   1.302  1.00  0.00           H  
HETATM   61  H   UNL     1       6.410   2.833   0.143  1.00  0.00           H  
HETATM   62  H   UNL     1       8.568   1.942   0.238  1.00  0.00           H  
CONECT    1   16   16   31   38                                       
CONECT    2   17   17   31   39                                       
CONECT    3   18   40   41   42                                       
CONECT    4    5    5    7   11                                       
CONECT    5   19    4    4   43                                       
CONECT    6   32   19   19   20                                       
CONECT    7   20   20    4   44                                       
CONECT    8   33   36   36   32                                       
CONECT    9   11   11   26   45                                       
CONECT   10   37   26   26   27                                       
CONECT   11    4   37    9    9                                       
CONECT   12   28   27   15   15                                       
CONECT   13   28   28   29   46                                       
CONECT   14   29   29   15   30                                       
CONECT   15   12   12   14   47                                       
CONECT   16   30    1    1   48                                       
CONECT   17   30    2    2   49                                       
CONECT   18   31    3   50   51                                       
CONECT   19    6    6    5   52                                       
CONECT   20    6    7    7   53                                       
CONECT   21   34   34   23   33                                       
CONECT   22   24   35   23   23                                       
CONECT   23   22   22   21   54                                       
CONECT   24   25   22   55   56                                       
CONECT   25   24   57   58   59                                       
CONECT   26    9   10   10                                            
CONECT   27   10   12   60                                            
CONECT   28   13   13   12                                            
CONECT   29   13   14   14                                            
CONECT   30   14   16   17                                            
CONECT   31    1    2   18                                            
CONECT   32    8    6   61                                            
CONECT   33   21    8   62                                            
CONECT   34   35   21   21                                            
CONECT   35   22   34                                                 
CONECT   36    8    8                                                 
CONECT   37   11   10                                                 
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   27                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
