COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.197   1.345  -0.016  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.621  -1.376   0.192  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.316  -3.712  -1.053  1.00  0.00           C  
HETATM    4  C   UNL     1       2.925   1.663  -0.102  1.00  0.00           C  
HETATM    5  C   UNL     1       3.516   1.236  -1.277  1.00  0.00           C  
HETATM    6  C   UNL     1       4.722   0.561  -1.238  1.00  0.00           C  
HETATM    7  C   UNL     1       4.746   0.742   1.149  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.438   0.129   0.114  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.935   1.416   0.010  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.573   1.630  -0.015  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.702   0.546   0.063  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.209  -0.757   0.169  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.586  -0.952   0.193  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.232   0.423   0.063  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.948  -0.949   0.168  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.876   0.899   0.004  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.604  -0.472   0.104  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.264  -3.092   0.345  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.767   1.869  -0.080  1.00  0.00           C  
HETATM   20  C   UNL     1       1.610   2.399  -0.145  1.00  0.00           C  
HETATM   21  C   UNL     1       5.337   0.314  -0.025  1.00  0.00           C  
HETATM   22  C   UNL     1       3.537   1.411   1.111  1.00  0.00           C  
HETATM   23  C   UNL     1       6.422  -2.289   0.165  1.00  0.00           C  
HETATM   24  C   UNL     1       7.690  -3.144   0.217  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.142  -1.637   0.230  1.00  0.00           N  
HETATM   26  N   UNL     1       0.509   1.436  -0.061  1.00  0.00           N  
HETATM   27  O   UNL     1      -1.005   3.058  -0.168  1.00  0.00           O  
HETATM   28  O   UNL     1       7.463  -0.277  -1.245  1.00  0.00           O  
HETATM   29  O   UNL     1       7.492  -0.085   1.221  1.00  0.00           O  
HETATM   30  S   UNL     1       6.878  -0.539   0.023  1.00  0.00           S  
HETATM   31  H   UNL     1      -3.413   2.400  -0.098  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.396  -2.430   0.273  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.176  -3.317  -1.594  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.402  -3.465  -1.594  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.407  -4.794  -0.967  1.00  0.00           H  
HETATM   36  H   UNL     1       3.035   1.429  -2.225  1.00  0.00           H  
HETATM   37  H   UNL     1       5.183   0.227  -2.156  1.00  0.00           H  
HETATM   38  H   UNL     1       5.227   0.548   2.097  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.506  -0.028   0.133  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.612   2.256  -0.052  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.183   2.633  -0.097  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.989  -1.951   0.274  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.580  -0.814   0.119  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.178  -3.339   0.886  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.404  -3.487   0.886  1.00  0.00           H  
HETATM   46  H   UNL     1       1.554   3.090   0.697  1.00  0.00           H  
HETATM   47  H   UNL     1       1.536   2.956  -1.078  1.00  0.00           H  
HETATM   48  H   UNL     1       3.076   1.745   2.029  1.00  0.00           H  
HETATM   49  H   UNL     1       5.823  -2.580  -0.698  1.00  0.00           H  
HETATM   50  H   UNL     1       5.844  -2.441   1.076  1.00  0.00           H  
HETATM   51  H   UNL     1       8.269  -2.991  -0.695  1.00  0.00           H  
HETATM   52  H   UNL     1       8.289  -2.853   1.080  1.00  0.00           H  
HETATM   53  H   UNL     1       7.416  -4.195   0.302  1.00  0.00           H  
HETATM   54  H   UNL     1       0.699   0.487   0.009  1.00  0.00           H  
CONECT    1   16   16   14   31                                       
CONECT    2   17   17   15   32                                       
CONECT    3   18   33   34   35                                       
CONECT    4   20   22   22    5                                       
CONECT    5    4    6    6   36                                       
CONECT    6    5    5   21   37                                       
CONECT    7   22   21   21   38                                       
CONECT    8    9    9   13   39                                       
CONECT    9   10    8    8   40                                       
CONECT   10   11   11    9   41                                       
CONECT   11   10   10   14   12                                       
CONECT   12   11   25   13   13                                       
CONECT   13   12   12    8   42                                       
CONECT   14    1   11   15   15                                       
CONECT   15   14   14    2   25                                       
CONECT   16   19    1    1   17                                       
CONECT   17   16    2    2   43                                       
CONECT   18   25    3   44   45                                       
CONECT   19   26   27   27   16                                       
CONECT   20   26    4   46   47                                       
CONECT   21    7    7    6   30                                       
CONECT   22    4    4    7   48                                       
CONECT   23   30   24   49   50                                       
CONECT   24   23   51   52   53                                       
CONECT   25   15   12   18                                            
CONECT   26   20   19   54                                            
CONECT   27   19   19                                                 
CONECT   28   30   30                                                 
CONECT   29   30   30                                                 
CONECT   30   21   28   28   23                                       
CONECT   30   29   29                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
