COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.198   1.147  -0.187  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.169   1.785   0.553  1.00  0.00           C  
HETATM    3  C   UNL     1       2.203   1.344   0.095  1.00  0.00           C  
HETATM    4  C   UNL     1       3.305   1.165   1.057  1.00  0.00           C  
HETATM    5  C   UNL     1       4.631   1.265   0.629  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.508   0.876  -0.659  1.00  0.00           C  
HETATM    7  C   UNL     1       3.026   0.900   2.401  1.00  0.00           C  
HETATM    8  C   UNL     1       1.906   0.549  -0.964  1.00  0.00           C  
HETATM    9  C   UNL     1       2.620  -0.668  -1.388  1.00  0.00           C  
HETATM   10  C   UNL     1       2.632  -1.796  -0.563  1.00  0.00           C  
HETATM   11  C   UNL     1       3.301  -2.932  -0.965  1.00  0.00           C  
HETATM   12  C   UNL     1       3.962  -2.957  -2.186  1.00  0.00           C  
HETATM   13  C   UNL     1       3.953  -1.838  -3.009  1.00  0.00           C  
HETATM   14  C   UNL     1       3.282  -0.699  -2.619  1.00  0.00           C  
HETATM   15  C   UNL     1       0.677   1.176  -1.629  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.878   2.310   0.389  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.226   2.509  -0.308  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.487  -0.138   0.286  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.306  -1.239  -0.540  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.591  -2.507  -0.072  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.057  -2.680   1.223  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.814  -4.033   3.026  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.239  -1.580   2.049  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.949  -0.312   1.584  1.00  0.00           C  
HETATM   25  C   UNL     1       1.158   2.463   0.088  1.00  0.00           C  
HETATM   26  C   UNL     1       5.659   1.096   1.533  1.00  0.00           C  
HETATM   27  C   UNL     1       5.377   0.828   2.866  1.00  0.00           C  
HETATM   28  C   UNL     1       4.060   0.734   3.297  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.481   0.411  -2.393  1.00  0.00           O  
HETATM   30  O   UNL     1       6.393   0.662   3.752  1.00  0.00           O  
HETATM   31  O   UNL     1       4.620  -4.080  -2.577  1.00  0.00           O  
HETATM   32  O   UNL     1       0.914   2.598  -1.354  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.076   1.396  -0.026  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.338  -3.929   1.683  1.00  0.00           O  
HETATM   35  O   UNL     1      -2.119   2.749  -1.668  1.00  0.00           O  
HETATM   36  S   UNL     1      -2.092   1.353  -1.403  1.00  0.00           S  
HETATM   37  H   UNL     1      -0.950   2.528   0.714  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.008   1.191   1.452  1.00  0.00           H  
HETATM   39  H   UNL     1       4.851   1.473  -0.407  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.517  -0.174  -0.367  1.00  0.00           H  
HETATM   41  H   UNL     1       2.002   0.827   2.737  1.00  0.00           H  
HETATM   42  H   UNL     1       2.119  -1.778   0.387  1.00  0.00           H  
HETATM   43  H   UNL     1       3.312  -3.805  -0.328  1.00  0.00           H  
HETATM   44  H   UNL     1       4.469  -1.862  -3.957  1.00  0.00           H  
HETATM   45  H   UNL     1       3.275   0.170  -3.259  1.00  0.00           H  
HETATM   46  H   UNL     1       0.513   0.902  -2.671  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.040   2.145   1.454  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.262   3.198   0.248  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.692   3.424   0.058  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.071   2.585  -1.384  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.943  -1.104  -1.548  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.451  -3.364  -0.714  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.999  -5.081   3.266  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.067  -3.630   3.710  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.741  -3.469   3.128  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.602  -1.716   3.056  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.086   0.543   2.228  1.00  0.00           H  
HETATM   58  H   UNL     1       1.436   3.371   0.623  1.00  0.00           H  
HETATM   59  H   UNL     1       6.684   1.173   1.203  1.00  0.00           H  
HETATM   60  H   UNL     1       3.846   0.529   4.335  1.00  0.00           H  
HETATM   61  H   UNL     1       6.678   1.480   4.182  1.00  0.00           H  
HETATM   62  H   UNL     1       4.076  -4.699  -3.082  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.950   1.455  -0.437  1.00  0.00           H  
CONECT    1   16   36   18                                            
CONECT    2   25    6   37   38                                       
CONECT    3   25    8    8    4                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4   26   39                                       
CONECT    6   36   15    2   40                                       
CONECT    7    4   28   28   41                                       
CONECT    8   15    3    3    9                                       
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11   42                                       
CONECT   11   12   12   10   43                                       
CONECT   12   13   31   11   11                                       
CONECT   13   14   14   12   44                                       
CONECT   14   13   13    9   45                                       
CONECT   15   32    6    8   46                                       
CONECT   16   17    1   47   48                                       
CONECT   17   33   16   49   50                                       
CONECT   18    1   19   19   24                                       
CONECT   19   18   18   20   51                                       
CONECT   20   19   21   21   52                                       
CONECT   21   20   20   23   34                                       
CONECT   22   34   53   54   55                                       
CONECT   23   24   24   21   56                                       
CONECT   24   18   23   23   57                                       
CONECT   25   32    2    3   58                                       
CONECT   26    5   27   27   59                                       
CONECT   27   26   26   28   30                                       
CONECT   28    7    7   27   60                                       
CONECT   29   36   36                                                 
CONECT   30   27   61                                                 
CONECT   31   12   62                                                 
CONECT   32   15   25                                                 
CONECT   33   17   63                                                 
CONECT   34   21   22                                                 
CONECT   35   36   36                                                 
CONECT   36   35   35    1   29                                       
CONECT   36   29    6                                                 
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   33                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
