COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.575   2.040  -0.648  1.00  0.00           N  
HETATM    2  N   UNL     1      -0.269   2.094  -0.799  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.170   0.822  -0.431  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.343   0.098  -0.150  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.578   0.762  -0.273  1.00  0.00           C  
HETATM    6  C   UNL     1       0.332  -1.246   0.145  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.040  -1.245  -0.274  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.998  -0.117   0.763  1.00  0.00           C  
HETATM    9  C1* UNL     1       2.294   0.242  -0.407  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.848   0.058   0.009  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.447   2.675  -0.900  1.00  0.00           C  
HETATM   12  C2* UNL     1       2.891   0.826   0.899  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.951   0.687   0.591  1.00  0.00           C  
HETATM   14  C3* UNL     1       4.391   0.469   0.757  1.00  0.00           C  
HETATM   15  C4* UNL     1       4.410  -0.688  -0.260  1.00  0.00           C  
HETATM   16  C5* UNL     1       5.059  -1.923   0.369  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.966  -1.155   0.195  1.00  0.00           N  
HETATM   18  N   UNL     1       0.869  -0.053  -0.237  1.00  0.00           N  
HETATM   19  O2* UNL     1       2.706   2.241   0.955  1.00  0.00           O  
HETATM   20  O3* UNL     1       5.126   1.589   0.259  1.00  0.00           O  
HETATM   21  O4* UNL     1       3.044  -0.975  -0.610  1.00  0.00           O  
HETATM   22  O5* UNL     1       5.178  -2.952  -0.616  1.00  0.00           O  
HETATM   23  S   UNL     1      -5.611  -1.730   0.180  1.00  0.00           S  
HETATM   24  H   UNL     1       0.900  -2.136   0.372  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.303  -1.891  -0.729  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.943   0.177   1.195  1.00  0.00           H  
HETATM   27  H1* UNL     1       2.446   0.929  -1.240  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.490   3.711  -1.202  1.00  0.00           H  
HETATM   29  H2* UNL     1       2.457   0.343   1.774  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.955   1.729   0.875  1.00  0.00           H  
HETATM   31  H3* UNL     1       4.797   0.142   1.715  1.00  0.00           H  
HETATM   32  H4* UNL     1       4.963  -0.389  -1.151  1.00  0.00           H  
HETATM   33 H5*1 UNL     1       6.049  -1.662   0.743  1.00  0.00           H  
HETATM   34 H5*2 UNL     1       4.440  -2.278   1.193  1.00  0.00           H  
HETATM   35  H2* UNL     1       3.063   2.653   1.754  1.00  0.00           H  
HETATM   36  H3* UNL     1       6.072   1.421   0.151  1.00  0.00           H  
HETATM   37  H5* UNL     1       5.582  -3.766  -0.287  1.00  0.00           H  
CONECT    1   11   11    5                                            
CONECT    2    3    3   11                                            
CONECT    3   18    2    2    4                                       
CONECT    4    3   17    5    5                                       
CONECT    5    4    4    1   10                                       
CONECT    6   18   17   17   24                                       
CONECT    7   10   10   23   25                                       
CONECT    8   13   13   23   26                                       
CONECT    9   21   12   18   27                                       
CONECT   10    5   13    7    7                                       
CONECT   11    2    1    1   28                                       
CONECT   12   14    9   19   29                                       
CONECT   13   10    8    8   30                                       
CONECT   14   15   20   12   31                                       
CONECT   15   16   14   21   32                                       
CONECT   16   22   15   33   34                                       
CONECT   17    6    6    4                                            
CONECT   18    9    6    3                                            
CONECT   19   12   35                                                 
CONECT   20   14   36                                                 
CONECT   21   15    9                                                 
CONECT   22   16   37                                                 
CONECT   23    7    8                                                 
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
