COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.249  -1.446  -0.797  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.460  -1.532  -0.125  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.664  -2.541   0.804  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.665  -0.780   0.350  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.952   0.157   0.714  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.347   2.132  -1.563  1.00  0.00           C  
HETATM    7  C   UNL     1     -10.193   2.234   0.705  1.00  0.00           C  
HETATM    8  C   UNL     1       1.064  -2.273  -1.271  1.00  0.00           C  
HETATM    9  C   UNL     1       4.133  -0.379  -0.223  1.00  0.00           C  
HETATM   10  C   UNL     1       5.384   1.094   1.350  1.00  0.00           C  
HETATM   11  C   UNL     1       7.441   1.085  -0.032  1.00  0.00           C  
HETATM   12  C   UNL     1       9.451   2.243   0.561  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.662  -3.457   1.060  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.456  -3.368   0.390  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.252  -2.367  -0.542  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.444  -0.630  -0.378  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.645   0.319  -0.065  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.932   1.256   0.299  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.320   1.067  -1.170  1.00  0.00           C  
HETATM   20  N   UNL     1     -10.532   2.010  -0.706  1.00  0.00           N  
HETATM   21  C   UNL     1      -9.191   1.173   1.166  1.00  0.00           C  
HETATM   22  C   UNL     1       2.013  -1.406  -0.485  1.00  0.00           C  
HETATM   23  O   UNL     1       1.656  -0.912   0.564  1.00  0.00           O  
HETATM   24  N   UNL     1       3.258  -1.179  -0.947  1.00  0.00           N  
HETATM   25  N   UNL     1       5.349  -0.093  -0.570  1.00  0.00           N  
HETATM   26  C   UNL     1       6.041   0.689   0.247  1.00  0.00           C  
HETATM   27  S   UNL     1       3.760   0.411   1.306  1.00  0.00           S  
HETATM   28  C   UNL     1       8.147   1.903   0.857  1.00  0.00           C  
HETATM   29  N   UNL     1      10.031   1.808  -0.541  1.00  0.00           N  
HETATM   30  C   UNL     1       9.399   1.039  -1.408  1.00  0.00           C  
HETATM   31  C   UNL     1       8.095   0.647  -1.188  1.00  0.00           C  
HETATM   32  H   UNL     1      -1.087  -0.661  -1.521  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.606  -2.611   1.329  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.099  -1.756   0.134  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.462  -0.702   1.419  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.386  -0.818   0.498  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.749   0.236   1.783  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.909   3.122  -1.438  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.635   1.991  -2.604  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.751   3.224   0.820  1.00  0.00           H  
HETATM   41  H   UNL     1     -11.097   2.168   1.311  1.00  0.00           H  
HETATM   42  H   UNL     1       1.490  -3.271  -1.381  1.00  0.00           H  
HETATM   43  H   UNL     1       0.903  -1.836  -2.256  1.00  0.00           H  
HETATM   44  H   UNL     1       5.784   1.727   2.129  1.00  0.00           H  
HETATM   45  H   UNL     1      10.005   2.870   1.243  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.820  -4.243   1.783  1.00  0.00           H  
HETATM   47  H   UNL     1       0.327  -4.085   0.591  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.210   1.294   0.152  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.847   0.240  -1.133  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.463   2.231   0.430  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.752   0.076  -1.308  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.433   1.168  -1.796  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.262   2.638  -1.006  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.928   1.349   2.209  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.638   0.183   1.065  1.00  0.00           H  
HETATM   56  H   UNL     1       3.544  -1.574  -1.786  1.00  0.00           H  
HETATM   57  H   UNL     1       7.679   2.263   1.761  1.00  0.00           H  
HETATM   58  H   UNL     1       9.912   0.706  -2.298  1.00  0.00           H  
HETATM   59  H   UNL     1       7.587   0.010  -1.897  1.00  0.00           H  
CONECT    1   15   15    2   32                                       
CONECT    2    1   16    3    3                                       
CONECT    3    2    2   13   33                                       
CONECT    4   16   17   34   35                                       
CONECT    5   17   18   36   37                                       
CONECT    6   19   20   38   39                                       
CONECT    7   20   21   40   41                                       
CONECT    8   22   15   42   43                                       
CONECT    9   27   25   25   24                                       
CONECT   10   26   26   27   44                                       
CONECT   11   28   28   31   26                                       
CONECT   12   29   29   28   45                                       
CONECT   13   14   14    3   46                                       
CONECT   14   15   13   13   47                                       
CONECT   15    8    1    1   14                                       
CONECT   16    2    4                                                 
CONECT   17    4    5   48   49                                       
CONECT   18   19    5   21   50                                       
CONECT   19    6   18   51   52                                       
CONECT   20    6    7   53                                            
CONECT   21   18    7   54   55                                       
CONECT   22   24   23   23    8                                       
CONECT   23   22   22                                                 
CONECT   24    9   22   56                                            
CONECT   25   26    9    9                                            
CONECT   26   11   10   10   25                                       
CONECT   27   10    9                                                 
CONECT   28   12   11   11   57                                       
CONECT   29   12   12   30                                            
CONECT   30   29   31   31   58                                       
CONECT   31   30   30   11   59                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   24                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
