COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.416   0.350  -0.087  1.00  0.00           N  
HETATM    2  N   UNL     1      -0.155  -0.912  -1.253  1.00  0.00           N  
HETATM    3  N   UNL     1       2.601   0.230   0.822  1.00  0.00           N  
HETATM    4  O   UNL     1      -3.349  -1.751   1.160  1.00  0.00           O  
HETATM    5  O   UNL     1       3.044  -2.697  -1.803  1.00  0.00           O  
HETATM    6  O   UNL     1       2.726   1.762   3.132  1.00  0.00           O  
HETATM    7  O   UNL     1       4.886   1.990   2.727  1.00  0.00           O  
HETATM    8  S   UNL     1      -3.729   2.327  -0.919  1.00  0.00           S  
HETATM    9  S   UNL     1       0.796   1.260  -2.391  1.00  0.00           S  
HETATM   10  S   UNL     1       4.590  -0.970  -0.125  1.00  0.00           S  
HETATM   11  C   UNL     1      -4.594  -1.217   1.074  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.680  -1.896   1.606  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.947  -1.352   1.518  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.141  -0.127   0.900  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.071   0.560   0.367  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.786   0.023   0.454  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.634   0.758  -0.111  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.945   2.458  -1.267  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.373   1.161  -0.675  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.685   0.364  -1.785  1.00  0.00           C  
HETATM   21  C   UNL     1       2.004  -0.075  -2.024  1.00  0.00           C  
HETATM   22  C   UNL     1       1.069  -1.314  -1.972  1.00  0.00           C  
HETATM   23  C   UNL     1       1.760  -2.457  -1.224  1.00  0.00           C  
HETATM   24  C   UNL     1       1.927  -2.075   0.248  1.00  0.00           C  
HETATM   25  C   UNL     1       0.571  -1.664   0.825  1.00  0.00           C  
HETATM   26  C   UNL     1       2.471  -3.274   1.027  1.00  0.00           C  
HETATM   27  C   UNL     1       2.891  -0.922   0.361  1.00  0.00           C  
HETATM   28  C   UNL     1       4.958   0.752   0.342  1.00  0.00           C  
HETATM   29  C   UNL     1       3.612   1.262   0.883  1.00  0.00           C  
HETATM   30  C   UNL     1       3.157   2.461   0.048  1.00  0.00           C  
HETATM   31  C   UNL     1       3.788   1.698   2.315  1.00  0.00           C  
HETATM   32  H   UNL     1      -0.854  -1.639  -1.294  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.110  -2.315   0.412  1.00  0.00           H  
HETATM   34  H   UNL     1       3.638  -1.934  -1.772  1.00  0.00           H  
HETATM   35  H   UNL     1       2.888   2.047   4.042  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.536  -2.851   2.089  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.790  -1.884   1.932  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.135   0.291   0.836  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.227   1.514  -0.114  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.765   2.503  -2.341  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.520   3.331  -0.770  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.640   1.410   0.091  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.377   0.176  -2.606  1.00  0.00           H  
HETATM   44  H   UNL     1       2.739  -0.170  -2.824  1.00  0.00           H  
HETATM   45  H   UNL     1       2.492   0.090  -1.063  1.00  0.00           H  
HETATM   46  H   UNL     1       0.817  -1.631  -2.984  1.00  0.00           H  
HETATM   47  H   UNL     1       1.153  -3.359  -1.299  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.203  -2.331   0.445  1.00  0.00           H  
HETATM   49  H   UNL     1       0.604  -1.729   1.913  1.00  0.00           H  
HETATM   50  H   UNL     1       0.345  -0.640   0.529  1.00  0.00           H  
HETATM   51  H   UNL     1       3.437  -3.566   0.615  1.00  0.00           H  
HETATM   52  H   UNL     1       2.590  -3.002   2.076  1.00  0.00           H  
HETATM   53  H   UNL     1       1.774  -4.107   0.945  1.00  0.00           H  
HETATM   54  H   UNL     1       5.722   0.786   1.118  1.00  0.00           H  
HETATM   55  H   UNL     1       5.266   1.330  -0.529  1.00  0.00           H  
HETATM   56  H   UNL     1       2.231   2.861   0.461  1.00  0.00           H  
HETATM   57  H   UNL     1       3.927   3.232   0.070  1.00  0.00           H  
HETATM   58  H   UNL     1       2.988   2.144  -0.981  1.00  0.00           H  
CONECT    1   19   17   17                                            
CONECT    2   22   20   32                                            
CONECT    3   27   27   29                                            
CONECT    4   11   33                                                 
CONECT    5   23   34                                                 
CONECT    6   31   35                                                 
CONECT    7   31   31                                                 
CONECT    8   18   17                                                 
CONECT    9   21   20                                                 
CONECT   10   27   28                                                 
CONECT   11    4   16   16   12                                       
CONECT   12   11   13   13   36                                       
CONECT   13   12   12   14   37                                       
CONECT   14   15   15   13   38                                       
CONECT   15   16   14   14   39                                       
CONECT   16   17   11   11   15                                       
CONECT   17    1    1    8   16                                       
CONECT   18   19    8   40   41                                       
CONECT   19   20   18    1   42                                       
CONECT   20    9    2   19   43                                       
CONECT   21    9   22   44   45                                       
CONECT   22   21    2   23   46                                       
CONECT   23   22   24    5   47                                       
CONECT   24   25   23   27   26                                       
CONECT   25   24   48   49   50                                       
CONECT   26   24   51   52   53                                       
CONECT   27   10   24    3    3                                       
CONECT   28   10   29   54   55                                       
CONECT   29   28    3   31   30                                       
CONECT   30   29   56   57   58                                       
CONECT   31   29    7    7    6                                       
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
