COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.202  -1.614  -2.362  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.503  -1.858  -1.962  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.866  -1.702  -0.630  1.00  0.00           C  
HETATM    4  C   UNL     1       0.744  -1.213  -1.441  1.00  0.00           C  
HETATM    5  C   UNL     1       5.339   1.459   0.252  1.00  0.00           C  
HETATM    6  C   UNL     1       4.998   0.231   0.785  1.00  0.00           C  
HETATM    7  C   UNL     1       5.893  -0.824   0.678  1.00  0.00           C  
HETATM    8  C   UNL     1       3.672   0.039   1.475  1.00  0.00           C  
HETATM    9  C   UNL     1       1.401  -0.619   0.887  1.00  0.00           C  
HETATM   10  C   UNL     1       7.372   0.655  -0.473  1.00  0.00           C  
HETATM   11  C   UNL     1       7.101  -0.601   0.036  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.802   2.778   0.242  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.872   3.262  -0.487  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.869   4.688  -0.973  1.00  0.00           C  
HETATM   15  C   UNL     1       8.682   0.908  -1.173  1.00  0.00           C  
HETATM   16  C   UNL     1       0.389  -1.049  -0.101  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.922  -1.300   0.303  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.871   0.641   0.392  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.802   1.467   0.682  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.945   2.437  -0.771  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.947   1.128  -0.326  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.530  -2.295  -2.974  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.181  -1.950  -0.230  1.00  0.00           N  
HETATM   24  N   UNL     1       6.498   1.634  -0.353  1.00  0.00           N  
HETATM   25  N   UNL     1       2.669  -0.386   0.495  1.00  0.00           N  
HETATM   26  O   UNL     1       1.089  -0.476   2.053  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.989  -1.076   2.069  1.00  0.00           O  
HETATM   28  O   UNL     1      -5.236  -1.425   1.032  1.00  0.00           O  
HETATM   29  S   UNL     1      -3.873  -1.028   0.959  1.00  0.00           S  
HETATM   30  H   UNL     1       0.075  -1.742  -3.398  1.00  0.00           H  
HETATM   31  H   UNL     1       1.760  -1.027  -1.757  1.00  0.00           H  
HETATM   32  H   UNL     1       4.646   2.284   0.327  1.00  0.00           H  
HETATM   33  H   UNL     1       5.654  -1.795   1.086  1.00  0.00           H  
HETATM   34  H   UNL     1       3.771  -0.723   2.248  1.00  0.00           H  
HETATM   35  H   UNL     1       3.360   0.979   1.930  1.00  0.00           H  
HETATM   36  H   UNL     1       7.821  -1.400  -0.065  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.964   3.422   0.464  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.410   4.735  -1.960  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.894   5.054  -1.031  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.302   5.308  -0.278  1.00  0.00           H  
HETATM   41  H   UNL     1       8.572   0.698  -2.237  1.00  0.00           H  
HETATM   42  H   UNL     1       8.972   1.950  -1.036  1.00  0.00           H  
HETATM   43  H   UNL     1       9.450   0.259  -0.752  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.202  -1.177   1.339  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.965   1.089   1.251  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.781   2.815  -1.340  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.782   0.482  -0.553  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.537  -3.383  -3.038  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.515  -1.942  -2.668  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.281  -1.876  -3.949  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.689  -2.662  -0.650  1.00  0.00           H  
HETATM   52  H   UNL     1       2.918  -0.500  -0.435  1.00  0.00           H  
CONECT    1    2    4    4   30                                       
CONECT    2   22    3    3    1                                       
CONECT    3   23    2    2   17                                       
CONECT    4    1    1   16   31                                       
CONECT    5    6    6   24   32                                       
CONECT    6    8    5    5    7                                       
CONECT    7    6   11   11   33                                       
CONECT    8   25    6   34   35                                       
CONECT    9   16   26   26   25                                       
CONECT   10   24   24   11   15                                       
CONECT   11    7    7   10   36                                       
CONECT   12   19   13   13   37                                       
CONECT   13   12   12   20   14                                       
CONECT   14   13   38   39   40                                       
CONECT   15   10   41   42   43                                       
CONECT   16   17   17    4    9                                       
CONECT   17    3   16   16   44                                       
CONECT   18   29   19   19   21                                       
CONECT   19   18   18   12   45                                       
CONECT   20   21   21   13   46                                       
CONECT   21   18   20   20   47                                       
CONECT   22    2   48   49   50                                       
CONECT   23    3   29   51                                            
CONECT   24    5   10   10                                            
CONECT   25    9    8   52                                            
CONECT   26    9    9                                                 
CONECT   27   29   29                                                 
CONECT   28   29   29                                                 
CONECT   29   23   28   28   27                                       
CONECT   29   27   18                                                 
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
