COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.468  -1.084  -0.250  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.617  -0.995   0.837  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.097  -0.742   0.892  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.493   0.063  -0.222  1.00  0.00           O  
HETATM    5  O   UNL     1      -1.056  -1.407   1.831  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.010  -3.306  -1.156  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.723   1.988  -0.441  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.441  -0.013   2.193  1.00  0.00           C  
HETATM    9  C   UNL     1       1.425  -0.165   0.107  1.00  0.00           C  
HETATM   10  C   UNL     1       2.707  -0.633   0.076  1.00  0.00           C  
HETATM   11  C   UNL     1       0.966  -2.324  -0.580  1.00  0.00           C  
HETATM   12  C   UNL     1       0.187  -3.434  -0.979  1.00  0.00           C  
HETATM   13  C   UNL     1       3.870   0.134   0.406  1.00  0.00           C  
HETATM   14  C   UNL     1       4.824   0.763   0.676  1.00  0.00           C  
HETATM   15  C   UNL     1       6.020   1.551   1.015  1.00  0.00           C  
HETATM   16  C   UNL     1       7.267   0.678   0.860  1.00  0.00           C  
HETATM   17  C   UNL     1       6.120   2.755   0.077  1.00  0.00           C  
HETATM   18  C   UNL     1       5.916   2.039   2.462  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.959   0.134   2.309  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.310   0.750   3.665  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.895  -0.787  -0.272  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.000  -0.432  -1.473  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.480  -0.261  -1.503  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.139   1.225  -1.632  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.733   1.774  -2.931  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.392   3.260  -3.060  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.977   4.023  -1.870  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.382   3.474  -0.571  1.00  0.00           C  
HETATM   29  S   UNL     1       2.717  -2.317  -0.428  1.00  0.00           S  
HETATM   30  O   UNL     1       0.771  -4.637  -1.165  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.437   0.983   1.263  1.00  0.00           O  
HETATM   32  H   UNL     1      -3.629  -1.693   0.857  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.806   1.864  -0.426  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.300   1.598   0.484  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.066  -0.587   3.040  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.979   0.974   2.189  1.00  0.00           H  
HETATM   37  H   UNL     1       1.181   0.848   0.390  1.00  0.00           H  
HETATM   38  H   UNL     1       7.341   0.331  -0.170  1.00  0.00           H  
HETATM   39  H   UNL     1       8.153   1.262   1.111  1.00  0.00           H  
HETATM   40  H   UNL     1       7.196  -0.180   1.528  1.00  0.00           H  
HETATM   41  H   UNL     1       5.232   3.377   0.188  1.00  0.00           H  
HETATM   42  H   UNL     1       7.006   3.339   0.328  1.00  0.00           H  
HETATM   43  H   UNL     1       6.194   2.408  -0.953  1.00  0.00           H  
HETATM   44  H   UNL     1       5.845   1.181   3.131  1.00  0.00           H  
HETATM   45  H   UNL     1       6.802   2.623   2.713  1.00  0.00           H  
HETATM   46  H   UNL     1       5.028   2.661   2.573  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.428  -0.846   2.223  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.842   1.730   3.750  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.391   0.855   3.747  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.946   0.102   4.463  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.251  -1.488  -1.573  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.448   0.131  -2.291  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.071  -0.800  -2.357  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.056   1.350  -1.647  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.317   1.230  -3.779  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.816   1.650  -2.916  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.309   3.384  -3.075  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.815   3.651  -3.985  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.734   5.081  -1.962  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.059   3.898  -1.855  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.798   4.018   0.277  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.299   3.599  -0.586  1.00  0.00           H  
HETATM   63  H   UNL     1       0.159  -5.334  -1.438  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.061   1.874   1.277  1.00  0.00           H  
CONECT    1   11   11   21    9                                       
CONECT    2    5    5    3   21                                       
CONECT    3    2    8    4   32                                       
CONECT    4    3   22                                                 
CONECT    5    2    2                                                 
CONECT    6   12   12                                                 
CONECT    7   24   28   33   34                                       
CONECT    8    3   19   35   36                                       
CONECT    9    1   10   10   37                                       
CONECT   10   29    9    9   13                                       
CONECT   11   12   29    1    1                                       
CONECT   12    6    6   30   11                                       
CONECT   13   10   14   14   14                                       
CONECT   14   13   13   13   15                                       
CONECT   15   14   18   16   17                                       
CONECT   16   15   38   39   40                                       
CONECT   17   15   41   42   43                                       
CONECT   18   15   44   45   46                                       
CONECT   19    8   31   20   47                                       
CONECT   20   19   48   49   50                                       
CONECT   21    2    1   23                                            
CONECT   22    4   23   51   52                                       
CONECT   23   22   21   24   53                                       
CONECT   24   23   25    7   54                                       
CONECT   25   24   26   55   56                                       
CONECT   26   25   27   57   58                                       
CONECT   27   26   28   59   60                                       
CONECT   28    7   27   61   62                                       
CONECT   29   11   10                                                 
CONECT   30   12   63                                                 
CONECT   31   19   64                                                 
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
