COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.466  -2.817  -7.557  1.00  0.00           N  
HETATM    2  C   UNL     1       6.991  -3.411  -6.396  1.00  0.00           C  
HETATM    3  N   UNL     1       7.442  -4.688  -6.428  1.00  0.00           N  
HETATM    4  C   UNL     1       7.936  -5.206  -5.277  1.00  0.00           C  
HETATM    5  N   UNL     1       8.050  -4.621  -4.065  1.00  0.00           N  
HETATM    6  C   UNL     1       7.587  -3.362  -4.106  1.00  0.00           C  
HETATM    7  C   UNL     1       7.056  -2.700  -5.202  1.00  0.00           C  
HETATM    8  N   UNL     1       6.687  -1.422  -4.864  1.00  0.00           N  
HETATM    9  C   UNL     1       6.989  -1.309  -3.588  1.00  0.00           C  
HETATM   10  N   UNL     1       7.537  -2.459  -3.082  1.00  0.00           N  
HETATM   11  C   UNL     1       7.981  -2.669  -1.702  1.00  0.00           C  
HETATM   12  O   UNL     1       7.125  -1.932  -0.804  1.00  0.00           O  
HETATM   13  C   UNL     1       9.420  -2.217  -1.446  1.00  0.00           C  
HETATM   14  O   UNL     1      10.075  -3.179  -0.621  1.00  0.00           O  
HETATM   15  C   UNL     1       9.234  -0.902  -0.713  1.00  0.00           C  
HETATM   16  O   UNL     1      10.316  -0.570   0.131  1.00  0.00           O  
HETATM   17  C   UNL     1       7.954  -1.145   0.067  1.00  0.00           C  
HETATM   18  C   UNL     1       7.228   0.131   0.454  1.00  0.00           C  
HETATM   19  S   UNL     1       5.724  -0.255   1.387  1.00  0.00           S  
HETATM   20  S   UNL     1       4.974   1.622   1.762  1.00  0.00           S  
HETATM   21  C   UNL     1       3.918   1.891   0.317  1.00  0.00           C  
HETATM   22  C   UNL     1       3.250   3.252   0.392  1.00  0.00           C  
HETATM   23  O   UNL     1       4.247   4.287   0.364  1.00  0.00           O  
HETATM   24  C   UNL     1       2.338   3.545  -0.788  1.00  0.00           C  
HETATM   25  O   UNL     1       1.071   2.941  -0.643  1.00  0.00           O  
HETATM   26  C   UNL     1       2.289   5.061  -0.788  1.00  0.00           C  
HETATM   27  O   UNL     1       1.306   5.546   0.125  1.00  0.00           O  
HETATM   28  C   UNL     1       3.680   5.447  -0.282  1.00  0.00           C  
HETATM   29  N   UNL     1       4.582   5.906  -1.339  1.00  0.00           N  
HETATM   30  C   UNL     1       4.785   7.207  -1.720  1.00  0.00           C  
HETATM   31  N   UNL     1       5.657   7.309  -2.701  1.00  0.00           N  
HETATM   32  C   UNL     1       6.036   6.017  -2.970  1.00  0.00           C  
HETATM   33  C   UNL     1       5.379   5.129  -2.134  1.00  0.00           C  
HETATM   34  N   UNL     1       5.501   3.794  -2.111  1.00  0.00           N  
HETATM   35  C   UNL     1       6.386   3.385  -3.046  1.00  0.00           C  
HETATM   36  N   UNL     1       7.097   4.130  -3.926  1.00  0.00           N  
HETATM   37  C   UNL     1       6.923   5.473  -3.893  1.00  0.00           C  
HETATM   38  N   UNL     1       7.633   6.300  -4.781  1.00  0.00           N  
HETATM   39  H   UNL     1       6.107  -1.882  -7.513  1.00  0.00           H  
HETATM   40  H   UNL     1       6.371  -3.365  -8.390  1.00  0.00           H  
HETATM   41  H   UNL     1       8.287  -6.230  -5.339  1.00  0.00           H  
HETATM   42  H   UNL     1       6.835  -0.428  -2.980  1.00  0.00           H  
HETATM   43  H   UNL     1       7.837  -3.738  -1.515  1.00  0.00           H  
HETATM   44  H   UNL     1      10.022  -2.112  -2.353  1.00  0.00           H  
HETATM   45  H   UNL     1       9.987  -4.044  -1.060  1.00  0.00           H  
HETATM   46  H   UNL     1       9.087  -0.094  -1.440  1.00  0.00           H  
HETATM   47  H   UNL     1       9.942  -0.066   0.869  1.00  0.00           H  
HETATM   48  H   UNL     1       8.147  -1.728   0.976  1.00  0.00           H  
HETATM   49  H   UNL     1       6.956   0.692  -0.443  1.00  0.00           H  
HETATM   50  H   UNL     1       7.877   0.758   1.069  1.00  0.00           H  
HETATM   51  H   UNL     1       4.532   1.820  -0.586  1.00  0.00           H  
HETATM   52  H   UNL     1       3.164   1.100   0.279  1.00  0.00           H  
HETATM   53  H   UNL     1       2.706   3.324   1.342  1.00  0.00           H  
HETATM   54  H   UNL     1       2.798   3.193  -1.719  1.00  0.00           H  
HETATM   55  H   UNL     1       0.792   2.675  -1.532  1.00  0.00           H  
HETATM   56  H   UNL     1       2.042   5.474  -1.771  1.00  0.00           H  
HETATM   57  H   UNL     1       0.488   5.044  -0.038  1.00  0.00           H  
HETATM   58  H   UNL     1       3.651   6.265   0.445  1.00  0.00           H  
HETATM   59  H   UNL     1       4.272   8.033  -1.246  1.00  0.00           H  
HETATM   60  H   UNL     1       6.549   2.314  -3.101  1.00  0.00           H  
HETATM   61  H   UNL     1       8.199   7.043  -4.417  1.00  0.00           H  
HETATM   62  H   UNL     1       7.491   6.199  -5.768  1.00  0.00           H  
CONECT    1    2   39   40                                            
CONECT    2    1    7    7    3                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5   41                                       
CONECT    5    4    6    6                                            
CONECT    6    5    5    7   10                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9    9                                            
CONECT    9    8    8   10   42                                       
CONECT   10    6    9   11                                            
CONECT   11   10   13   12   43                                       
CONECT   12   11   17                                                 
CONECT   13   11   14   15   44                                       
CONECT   14   13   45                                                 
CONECT   15   13   16   17   46                                       
CONECT   16   15   47                                                 
CONECT   17   12   15   18   48                                       
CONECT   18   17   19   49   50                                       
CONECT   19   18   20                                                 
CONECT   20   19   21                                                 
CONECT   21   20   22   51   52                                       
CONECT   22   21   23   24   53                                       
CONECT   23   22   28                                                 
CONECT   24   22   26   25   54                                       
CONECT   25   24   55                                                 
CONECT   26   24   28   27   56                                       
CONECT   27   26   57                                                 
CONECT   28   23   26   29   58                                       
CONECT   29   28   30   33                                            
CONECT   30   29   31   31   59                                       
CONECT   31   30   30   32                                            
CONECT   32   31   37   33   33                                       
CONECT   33   29   32   32   34                                       
CONECT   34   33   35   35                                            
CONECT   35   34   34   36   60                                       
CONECT   36   35   37   37                                            
CONECT   37   32   36   36   38                                       
CONECT   38   37   61   62                                            
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    4                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   35                                                      
CONECT   61   38                                                      
CONECT   62   38                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
