COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.188   1.694   0.290  1.00  0.00           N  
HETATM    2  C   UNL     1       4.865   0.538   0.138  1.00  0.00           C  
HETATM    3  C   UNL     1       6.873  -0.883   0.058  1.00  0.00           C  
HETATM    4  C   UNL     1       7.675  -2.597  -1.408  1.00  0.00           C  
HETATM    5  C   UNL     1       7.004  -1.740   1.133  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.553  -2.029  -0.023  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.390   0.857   1.017  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.480  -0.175   0.718  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.175   1.048  -1.255  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.105   2.117  -1.015  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.911   1.483  -0.295  1.00  0.00           C  
HETATM   12  C   UNL     1       0.364   2.090   0.020  1.00  0.00           C  
HETATM   13  C   UNL     1       2.802   1.710   0.168  1.00  0.00           C  
HETATM   14  C   UNL     1       6.366   0.521   0.270  1.00  0.00           C  
HETATM   15  C   UNL     1       7.211  -1.310  -1.213  1.00  0.00           C  
HETATM   16  C   UNL     1       7.802  -3.457  -0.333  1.00  0.00           C  
HETATM   17  C   UNL     1       7.470  -3.027   0.938  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.663  -0.399  -0.140  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.600   0.480   0.031  1.00  0.00           N  
HETATM   20  N   UNL     1       0.800   0.882  -0.169  1.00  0.00           N  
HETATM   21  N   UNL     1       2.044   0.688  -0.094  1.00  0.00           N  
HETATM   22  N   UNL     1      -6.214  -0.700  -1.273  1.00  0.00           N  
HETATM   23  N   UNL     1      -7.259  -1.596  -1.209  1.00  0.00           N  
HETATM   24  N   UNL     1      -8.562  -2.937   0.275  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.933   2.487  -0.016  1.00  0.00           O  
HETATM   26  O   UNL     1       4.265  -0.488  -0.105  1.00  0.00           O  
HETATM   27  S   UNL     1       1.758   3.123   0.341  1.00  0.00           S  
HETATM   28  S   UNL     1      -6.467  -1.290   1.148  1.00  0.00           S  
HETATM   29  H   UNL     1       4.668   2.514   0.488  1.00  0.00           H  
HETATM   30  H   UNL     1       7.939  -2.931  -2.401  1.00  0.00           H  
HETATM   31  H   UNL     1       6.744  -1.405   2.126  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.793   1.634   1.666  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.552   0.367   1.514  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.072  -0.960   0.081  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.833  -0.612   1.652  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.033   1.499  -1.755  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.764   0.257  -1.883  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.778   2.527  -1.970  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.519   2.915  -0.398  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.472   0.711  -0.928  1.00  0.00           H  
HETATM   41  H   UNL     1       6.804   1.182  -0.477  1.00  0.00           H  
HETATM   42  H   UNL     1       6.647   0.861   1.267  1.00  0.00           H  
HETATM   43  H   UNL     1       7.112  -0.638  -2.053  1.00  0.00           H  
HETATM   44  H   UNL     1       8.166  -4.463  -0.486  1.00  0.00           H  
HETATM   45  H   UNL     1       7.573  -3.698   1.779  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.712  -3.211   1.193  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.117  -3.296  -0.435  1.00  0.00           H  
CONECT    1    2   13   29                                            
CONECT    2   26   26   14    1                                       
CONECT    3    5   14   15   15                                       
CONECT    4   16   16   15   30                                       
CONECT    5   17   17    3   31                                       
CONECT    6   23   23   28   24                                       
CONECT    7   11    8   32   33                                       
CONECT    8   19    7   34   35                                       
CONECT    9   10   19   36   37                                       
CONECT   10    9   11   38   39                                       
CONECT   11   10   25    7   40                                       
CONECT   12   20   20   27   25                                       
CONECT   13   21   21    1   27                                       
CONECT   14    3    2   41   42                                       
CONECT   15    3    3    4   43                                       
CONECT   16   17    4    4   44                                       
CONECT   17    5    5   16   45                                       
CONECT   18   22   22   19   28                                       
CONECT   19    9    8   18                                            
CONECT   20   21   12   12                                            
CONECT   21   20   13   13                                            
CONECT   22   23   18   18                                            
CONECT   23   22    6    6                                            
CONECT   24    6   46   47                                            
CONECT   25   12   11                                                 
CONECT   26    2    2                                                 
CONECT   27   13   12                                                 
CONECT   28   18    6                                                 
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
