COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.850  -3.003   1.434  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.567  -3.266   0.106  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.954  -1.696   1.874  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.386  -2.223  -0.783  1.00  0.00           C  
HETATM    5  C   UNL     1       1.521   0.944  -0.073  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.773  -0.657   0.979  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.491  -0.918  -0.337  1.00  0.00           C  
HETATM    8  C   UNL     1       0.328   0.443  -0.551  1.00  0.00           C  
HETATM    9  C   UNL     1       2.579   0.010  -0.099  1.00  0.00           C  
HETATM   10  C   UNL     1       1.677   2.317   0.412  1.00  0.00           C  
HETATM   11  C   UNL     1       4.730  -0.782   0.209  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.886   0.774   1.464  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.169   1.380   0.890  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.930   1.941  -0.498  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.646   0.895  -1.557  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.291   0.223  -1.313  1.00  0.00           C  
HETATM   17  N   UNL     1       0.340  -0.830  -0.964  1.00  0.00           N  
HETATM   18  N   UNL     1       2.873   2.740   0.866  1.00  0.00           N  
HETATM   19  N   UNL     1       6.002  -0.583   0.609  1.00  0.00           N  
HETATM   20  N   UNL     1       3.841   0.208   0.298  1.00  0.00           N  
HETATM   21  O   UNL     1       0.726   3.077   0.404  1.00  0.00           O  
HETATM   22  O   UNL     1       4.393  -1.866  -0.235  1.00  0.00           O  
HETATM   23  S   UNL     1       1.908  -1.434  -0.748  1.00  0.00           S  
HETATM   24  S   UNL     1      -1.133   1.426  -0.614  1.00  0.00           S  
HETATM   25  H   UNL     1      -2.995  -3.819   2.127  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.487  -4.287  -0.236  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.176  -1.488   2.910  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.165  -2.426  -1.821  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.928   0.789   2.553  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.024   1.346   1.119  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.899  -0.164  -2.253  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.416  -1.320  -1.323  1.00  0.00           H  
HETATM   33  H   UNL     1       3.631   2.135   0.872  1.00  0.00           H  
HETATM   34  H   UNL     1       2.976   3.650   1.186  1.00  0.00           H  
HETATM   35  H   UNL     1       6.270   0.279   0.963  1.00  0.00           H  
HETATM   36  H   UNL     1       6.649  -1.303   0.544  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.937   0.608   0.837  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.511   2.180   1.546  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.812   2.507  -0.799  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.084   2.626  -0.452  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.430   0.138  -1.533  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.638   1.370  -2.538  1.00  0.00           H  
CONECT    1    2    3    3   25                                       
CONECT    2    1    4    4   26                                       
CONECT    3    1    1    6   27                                       
CONECT    4    2    2    7   28                                       
CONECT    5    8    8    9   10                                       
CONECT    6    3    7    7   12                                       
CONECT    7    4    6    6   16                                       
CONECT    8    5    5   17   24                                       
CONECT    9    5   20   20   23                                       
CONECT   10    5   18   21   21                                       
CONECT   11   19   20   22   22                                       
CONECT   12    6   13   29   30                                       
CONECT   13   12   14   37   38                                       
CONECT   14   13   15   39   40                                       
CONECT   15   14   16   41   42                                       
CONECT   16    7   24   15   31                                       
CONECT   17    8   23   32                                            
CONECT   18   10   33   34                                            
CONECT   19   11   35   36                                            
CONECT   20    9    9   11                                            
CONECT   21   10   10                                                 
CONECT   22   11   11                                                 
CONECT   23    9   17                                                 
CONECT   24    8   16                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
