COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.947  -1.036   0.307  1.00  0.00           N  
HETATM    2  N   UNL     1      -7.111   1.240  -0.703  1.00  0.00           N  
HETATM    3  C   UNL     1       3.577   0.620   0.209  1.00  0.00           C  
HETATM    4  C   UNL     1       3.290  -0.693  -0.219  1.00  0.00           C  
HETATM    5  C   UNL     1       2.138  -1.504  -0.209  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.239  -1.895   0.308  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.479  -1.039   0.329  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.643   0.892   1.144  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.468   2.373  -0.066  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.718  -0.598  -0.419  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.218  -2.793   1.546  1.00  0.00           C  
HETATM   12  C   UNL     1       3.364  -3.187  -1.205  1.00  0.00           C  
HETATM   13  C   UNL     1       4.479  -1.224  -0.758  1.00  0.00           C  
HETATM   14  O   UNL     1      -6.688   2.917   0.687  1.00  0.00           O  
HETATM   15  C   UNL     1      -8.837   2.963  -0.288  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.852   0.698  -0.499  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.954   1.197   0.278  1.00  0.00           N  
HETATM   18  S   UNL     1      -5.256  -0.769  -1.262  1.00  0.00           S  
HETATM   19  C   UNL     1      -3.774   0.553   0.373  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.520   0.103   1.116  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.570  -1.387  -0.436  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.457  -3.690   1.547  1.00  0.00           C  
HETATM   23  C   UNL     1       1.041  -3.662   1.524  1.00  0.00           C  
HETATM   24  N   UNL     1       2.227  -2.732  -0.710  1.00  0.00           N  
HETATM   25  N   UNL     1       4.465  -2.467  -1.236  1.00  0.00           N  
HETATM   26  N   UNL     1       5.441  -0.259  -0.655  1.00  0.00           N  
HETATM   27  C   UNL     1       4.886   0.866  -0.070  1.00  0.00           C  
HETATM   28  C   UNL     1       5.597   2.119   0.212  1.00  0.00           C  
HETATM   29  O   UNL     1       5.011   3.046   0.739  1.00  0.00           O  
HETATM   30  N   UNL     1       6.899   2.243  -0.113  1.00  0.00           N  
HETATM   31  C   UNL     1       7.609   3.493   0.169  1.00  0.00           C  
HETATM   32  C   UNL     1       9.062   3.371  -0.295  1.00  0.00           C  
HETATM   33  H   UNL     1       0.897  -0.139   0.674  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.735   0.805  -1.305  1.00  0.00           H  
HETATM   35  H   UNL     1       2.883   1.307   0.670  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.241  -2.513  -0.590  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.661   1.776   1.765  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.217  -2.174   2.444  1.00  0.00           H  
HETATM   39  H   UNL     1       3.391  -4.191  -1.602  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.391   2.340  -0.991  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.373   3.006   0.660  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.737   3.969  -0.695  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.661   0.374   1.711  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.535  -2.274  -1.051  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.459  -4.309   0.649  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.442  -4.330   2.429  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.354  -3.071   1.562  1.00  0.00           H  
HETATM   48  H   UNL     1       1.924  -3.023   1.524  1.00  0.00           H  
HETATM   49  H   UNL     1       1.056  -4.302   2.406  1.00  0.00           H  
HETATM   50  H   UNL     1       1.040  -4.281   0.627  1.00  0.00           H  
HETATM   51  H   UNL     1       6.362  -0.347  -0.948  1.00  0.00           H  
HETATM   52  H   UNL     1       7.367   1.504  -0.533  1.00  0.00           H  
HETATM   53  H   UNL     1       7.126   4.313  -0.363  1.00  0.00           H  
HETATM   54  H   UNL     1       7.585   3.691   1.240  1.00  0.00           H  
HETATM   55  H   UNL     1       9.545   2.551   0.237  1.00  0.00           H  
HETATM   56  H   UNL     1       9.086   3.172  -1.366  1.00  0.00           H  
HETATM   57  H   UNL     1       9.590   4.301  -0.085  1.00  0.00           H  
CONECT    1    5    6   33                                            
CONECT    2   16    9   34                                            
CONECT    3   27   27    4   35                                       
CONECT    4    3    5    5   13                                       
CONECT    5    4    4    1   24                                       
CONECT    6    1    7   11   36                                       
CONECT    7    6   20   20   21                                       
CONECT    8   20   19   19   37                                       
CONECT    9    2   15   14   14                                       
CONECT   10   18   19   21   21                                       
CONECT   11    6   23   22   38                                       
CONECT   12   24   24   25   39                                       
CONECT   13   25   25    4   26                                       
CONECT   14    9    9                                                 
CONECT   15    9   40   41   42                                       
CONECT   16   17   17    2   18                                       
CONECT   17   19   16   16                                            
CONECT   18   16   10                                                 
CONECT   19    8    8   17   10                                       
CONECT   20    7    7    8   43                                       
CONECT   21   10   10    7   44                                       
CONECT   22   11   45   46   47                                       
CONECT   23   11   48   49   50                                       
CONECT   24    5   12   12                                            
CONECT   25   12   13   13                                            
CONECT   26   13   27   51                                            
CONECT   27   28    3    3   26                                       
CONECT   28   30   29   29   27                                       
CONECT   29   28   28                                                 
CONECT   30   31   28   52                                            
CONECT   31   32   30   53   54                                       
CONECT   32   31   55   56   57                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
