COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.515   0.929  -0.630  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.906   3.730  -0.774  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.631   3.737   1.613  1.00  0.00           C  
HETATM    4  C   UNL     1       1.397   1.642  -0.243  1.00  0.00           C  
HETATM    5  C   UNL     1       1.283  -1.129  -0.455  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.225  -1.898   0.236  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.806   3.040   0.426  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.106  -1.126   0.250  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.605  -2.005  -0.255  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.865  -0.795  -2.295  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.150  -3.480   2.245  1.00  0.00           C  
HETATM   12  C   UNL     1       4.152  -2.364   1.280  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.656   5.802   0.400  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.831   5.109  -0.784  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.557   5.117   1.597  1.00  0.00           C  
HETATM   16  C   UNL     1       0.155  -0.415  -0.052  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.256  -1.009  -0.434  1.00  0.00           C  
HETATM   18  C   UNL     1       2.461  -0.456  -0.737  1.00  0.00           C  
HETATM   19  C   UNL     1       0.215   0.980   0.047  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.566  -2.485   1.275  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.615  -0.191  -1.644  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.999  -0.950  -1.280  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.296  -2.020   1.282  1.00  0.00           N  
HETATM   24  N   UNL     1       3.598  -1.171  -1.129  1.00  0.00           N  
HETATM   25  O   UNL     1      -5.371  -2.865   0.126  1.00  0.00           O  
HETATM   26  O   UNL     1       5.152  -0.060   0.379  1.00  0.00           O  
HETATM   27  O   UNL     1       5.808  -2.134  -0.800  1.00  0.00           O  
HETATM   28  O   UNL     1      -0.880   1.683   0.439  1.00  0.00           O  
HETATM   29  S   UNL     1       4.854  -1.376  -0.070  1.00  0.00           S  
HETATM   30  H   UNL     1       3.434   1.450  -0.855  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.038   3.188  -1.699  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.554   3.203   2.548  1.00  0.00           H  
HETATM   33  H   UNL     1       1.444   2.719  -0.167  1.00  0.00           H  
HETATM   34  H   UNL     1       1.241  -2.205  -0.538  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.196  -0.144  -3.104  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.616  -1.774  -2.704  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.004  -4.490   1.862  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.651  -3.382   3.209  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.216  -3.286   2.365  1.00  0.00           H  
HETATM   40  H   UNL     1       3.276  -1.857   1.684  1.00  0.00           H  
HETATM   41  H   UNL     1       3.862  -3.344   0.899  1.00  0.00           H  
HETATM   42  H   UNL     1       4.897  -2.486   2.066  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.598   6.880   0.389  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.908   5.646  -1.718  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.421   5.661   2.520  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.789  -0.207  -2.355  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.821   0.836  -1.343  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.908  -1.261  -1.793  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.170   0.002  -0.776  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.615  -2.280   1.923  1.00  0.00           H  
HETATM   51  H   UNL     1       3.650  -1.548  -2.022  1.00  0.00           H  
CONECT    1   18    4    4   30                                       
CONECT    2    7    7   14   31                                       
CONECT    3    7   15   15   32                                       
CONECT    4    1    1   19   33                                       
CONECT    5   18   18   16   34                                       
CONECT    6    9   17   20   20                                       
CONECT    7   28    2    2    3                                       
CONECT    8   17   17   23   16                                       
CONECT    9   22   25   25    6                                       
CONECT   10   22   21   35   36                                       
CONECT   11   20   37   38   39                                       
CONECT   12   29   40   41   42                                       
CONECT   13   14   14   15   43                                       
CONECT   14    2   13   13   44                                       
CONECT   15    3    3   13   45                                       
CONECT   16    5    8   19   19                                       
CONECT   17   21    6    8    8                                       
CONECT   18   24    5    5    1                                       
CONECT   19   16   16    4   28                                       
CONECT   20    6    6   11   23                                       
CONECT   21   10   17   46   47                                       
CONECT   22    9   10   48   49                                       
CONECT   23   20    8   50                                            
CONECT   24   29   18   51                                            
CONECT   25    9    9                                                 
CONECT   26   29   29                                                 
CONECT   27   29   29                                                 
CONECT   28   19    7                                                 
CONECT   29   27   27   12   26                                       
CONECT   29   26   24                                                 
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
