COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.769  -0.116   2.075  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.385   0.879  -0.117  1.00  0.00           N  
HETATM    3  C   UNL     1      -4.688   2.048   1.905  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.136   2.214   0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.146  -0.322  -1.175  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.075  -1.684  -0.943  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.707  -1.495  -0.592  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.786  -0.123  -0.827  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.004   0.456  -1.117  1.00  0.00           C  
HETATM   10  C   UNL     1       0.600  -2.123  -0.280  1.00  0.00           C  
HETATM   11  C   UNL     1       0.694  -3.513  -0.155  1.00  0.00           C  
HETATM   12  C   UNL     1       2.938  -3.326   0.283  1.00  0.00           C  
HETATM   13  C   UNL     1       2.848  -1.931   0.153  1.00  0.00           C  
HETATM   14  C   UNL     1       4.052  -1.092   0.325  1.00  0.00           C  
HETATM   15  C   UNL     1       5.096   1.047   0.381  1.00  0.00           C  
HETATM   16  C   UNL     1       5.151   2.259  -0.304  1.00  0.00           C  
HETATM   17  C   UNL     1       6.290   3.043  -0.225  1.00  0.00           C  
HETATM   18  C   UNL     1       7.368   2.624   0.532  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.377   1.203   4.067  1.00  0.00           C  
HETATM   20  C   UNL     1       7.314   1.421   1.212  1.00  0.00           C  
HETATM   21  C   UNL     1       6.181   0.632   1.139  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.261  -0.040   0.626  1.00  0.00           C  
HETATM   23  C   UNL     1       4.218   3.923  -1.723  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.861  -2.274  -0.652  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.679   1.241   2.630  1.00  0.00           N  
HETATM   26  N   UNL     1       1.853  -4.077   0.122  1.00  0.00           N  
HETATM   27  N   UNL     1       1.677  -1.367  -0.126  1.00  0.00           N  
HETATM   28  N   UNL     1       3.945   0.252   0.310  1.00  0.00           N  
HETATM   29  N   UNL     1       4.153  -3.918   0.572  1.00  0.00           N  
HETATM   30  O   UNL     1      -5.520  -0.608  -2.082  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.406   1.623  -2.257  1.00  0.00           O  
HETATM   32  O   UNL     1       5.139  -1.613   0.480  1.00  0.00           O  
HETATM   33  O   UNL     1       4.090   2.670  -1.049  1.00  0.00           O  
HETATM   34  S   UNL     1      -4.698   0.423  -1.553  1.00  0.00           S  
HETATM   35  H   UNL     1      -6.470  -0.705   2.666  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.786  -0.586   2.101  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.720   1.548   1.934  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.605   3.029   2.373  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.352   2.713  -0.121  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.052   2.804   0.412  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.969  -2.286  -0.990  1.00  0.00           H  
HETATM   42  H   UNL     1       0.105   0.485  -0.781  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.066   1.519  -1.298  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.185  -4.126  -0.286  1.00  0.00           H  
HETATM   45  H   UNL     1       6.336   3.983  -0.755  1.00  0.00           H  
HETATM   46  H   UNL     1       8.255   3.237   0.592  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.424   0.697   4.225  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.315   2.220   4.453  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.166   0.663   4.590  1.00  0.00           H  
HETATM   50  H   UNL     1       8.159   1.097   1.802  1.00  0.00           H  
HETATM   51  H   UNL     1       6.142  -0.307   1.671  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.221  -1.030   0.173  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.285   0.334   0.606  1.00  0.00           H  
HETATM   54  H   UNL     1       4.387   4.714  -0.993  1.00  0.00           H  
HETATM   55  H   UNL     1       5.061   3.880  -2.413  1.00  0.00           H  
HETATM   56  H   UNL     1       3.304   4.131  -2.279  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.806  -3.337  -0.471  1.00  0.00           H  
HETATM   58  H   UNL     1       3.071   0.668   0.249  1.00  0.00           H  
HETATM   59  H   UNL     1       4.958  -3.379   0.610  1.00  0.00           H  
HETATM   60  H   UNL     1       4.200  -4.873   0.738  1.00  0.00           H  
CONECT    1   22   25   35   36                                       
CONECT    2   22    4   34                                            
CONECT    3   25    4   37   38                                       
CONECT    4    2    3   39   40                                       
CONECT    5    9   34    6    6                                       
CONECT    6    5    5   24   41                                       
CONECT    7    8   10   24   24                                       
CONECT    8    9    9    7   42                                       
CONECT    9    8    8    5   43                                       
CONECT   10   11    7   27   27                                       
CONECT   11   26   26   10   44                                       
CONECT   12   26   29   13   13                                       
CONECT   13   12   12   27   14                                       
CONECT   14   13   28   32   32                                       
CONECT   15   28   16   16   21                                       
CONECT   16   33   15   15   17                                       
CONECT   17   16   18   18   45                                       
CONECT   18   17   17   20   46                                       
CONECT   19   25   47   48   49                                       
CONECT   20   21   21   18   50                                       
CONECT   21   15   20   20   51                                       
CONECT   22    1    2   52   53                                       
CONECT   23   33   54   55   56                                       
CONECT   24    7    7    6   57                                       
CONECT   25    1   19    3                                            
CONECT   26   11   11   12                                            
CONECT   27   10   10   13                                            
CONECT   28   14   15   58                                            
CONECT   29   12   59   60                                            
CONECT   30   34   34                                                 
CONECT   31   34   34                                                 
CONECT   32   14   14                                                 
CONECT   33   23   16                                                 
CONECT   34   30   30    2    5                                       
CONECT   34   31   31                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   11                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
