COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.994   3.134  -0.946  1.00  0.00           C  
HETATM    2  C   UNL     1       5.600  -1.324   1.301  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.318   3.132   1.070  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.444   0.500   0.056  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.301  -2.545  -0.061  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.399   1.822   0.621  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.016  -1.188  -1.262  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.190   0.963  -0.166  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.191  -0.313  -0.657  1.00  0.00           C  
HETATM   10  C   UNL     1       2.807  -0.580   0.095  1.00  0.00           C  
HETATM   11  C   UNL     1       5.417   1.841  -0.430  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.628  -1.440  -0.733  1.00  0.00           C  
HETATM   13  C   UNL     1       5.246  -0.074   0.537  1.00  0.00           C  
HETATM   14  C   UNL     1       0.513  -0.914  -0.396  1.00  0.00           C  
HETATM   15  C   UNL     1       4.024   0.236   0.018  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.907   1.725   0.951  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.967   0.411   0.445  1.00  0.00           C  
HETATM   18  N   UNL     1       6.073   0.935   0.245  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.636  -0.584  -0.898  1.00  0.00           N  
HETATM   20  N   UNL     1       1.665  -0.142  -0.469  1.00  0.00           N  
HETATM   21  N   UNL     1      -3.770  -0.380  -0.294  1.00  0.00           N  
HETATM   22  O   UNL     1       2.830  -1.653   0.669  1.00  0.00           O  
HETATM   23  O   UNL     1       4.150   1.442  -0.583  1.00  0.00           O  
HETATM   24  S   UNL     1       0.402  -2.436   0.377  1.00  0.00           S  
HETATM   25  H   UNL     1       6.391   2.979  -1.949  1.00  0.00           H  
HETATM   26  H   UNL     1       5.213   3.893  -0.978  1.00  0.00           H  
HETATM   27  H   UNL     1       6.795   3.464  -0.285  1.00  0.00           H  
HETATM   28  H   UNL     1       5.941  -2.090   0.605  1.00  0.00           H  
HETATM   29  H   UNL     1       6.393  -1.102   2.014  1.00  0.00           H  
HETATM   30  H   UNL     1       4.721  -1.684   1.835  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.830   3.675   1.863  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.255   3.062   1.305  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.447   3.661   0.125  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.847  -0.504  -0.072  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.997   1.016   0.842  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.541   1.053  -0.879  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.966  -3.362   0.177  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.920   2.326   1.435  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.532   2.387  -0.302  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.953  -0.654  -2.210  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.525  -2.140  -1.414  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.309   1.501  -1.106  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.130   0.880   0.073  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.584  -1.323  -0.775  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.300   0.231  -1.595  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.777   1.195   1.895  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.870  -0.140   1.381  1.00  0.00           H  
HETATM   48  H   UNL     1       1.647   0.713  -0.927  1.00  0.00           H  
CONECT    1   11   25   26   27                                       
CONECT    2   13   28   29   30                                       
CONECT    3   16   31   32   33                                       
CONECT    4   17   34   35   36                                       
CONECT    5   12   12   24   37                                       
CONECT    6   17   16   38   39                                       
CONECT    7   12   21   40   41                                       
CONECT    8   21   16   42   43                                       
CONECT    9   21   17   44   45                                       
CONECT   10   15   20   22   22                                       
CONECT   11    1   18   18   23                                       
CONECT   12   19    7    5    5                                       
CONECT   13   18   15   15    2                                       
CONECT   14   20   19   19   24                                       
CONECT   15   23   13   13   10                                       
CONECT   16    8    6    3   46                                       
CONECT   17    9    4    6   47                                       
CONECT   18   11   11   13                                            
CONECT   19   14   14   12                                            
CONECT   20   10   14   48                                            
CONECT   21    7    9    8                                            
CONECT   22   10   10                                                 
CONECT   23   11   15                                                 
CONECT   24   14    5                                                 
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   20                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
