COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.525   1.343  -0.232  1.00  0.00           C  
HETATM    2  O   UNL     1       0.513   1.588  -1.639  1.00  0.00           O  
HETATM    3  C   UNL     1       0.900  -0.117   0.032  1.00  0.00           C  
HETATM    4  N   UNL     1       2.261  -0.364  -0.449  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.070  -1.044  -0.695  1.00  0.00           C  
HETATM    6  O   UNL     1       0.435  -2.380  -0.654  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.447  -1.007  -0.038  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.304  -1.189   1.372  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.120   0.341  -0.310  1.00  0.00           C  
HETATM   10  S   UNL     1      -1.127   1.661   0.456  1.00  0.00           S  
HETATM   11  C   UNL     1      -3.526   0.343   0.292  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.266  -0.766  -0.224  1.00  0.00           O  
HETATM   13  C   UNL     1       3.317  -0.084   0.340  1.00  0.00           C  
HETATM   14  O   UNL     1       3.140   0.372   1.450  1.00  0.00           O  
HETATM   15  C   UNL     1       4.717  -0.338  -0.155  1.00  0.00           C  
HETATM   16  H   UNL     1       1.252   1.999   0.247  1.00  0.00           H  
HETATM   17  H   UNL     1       0.278   2.495  -1.879  1.00  0.00           H  
HETATM   18  H   UNL     1       0.855  -0.315   1.103  1.00  0.00           H  
HETATM   19  H   UNL     1       2.403  -0.729  -1.337  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.160  -0.726  -1.734  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.130  -3.028  -1.097  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.064  -1.808  -0.445  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.144  -1.267   1.846  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.181   0.508  -1.386  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.457   0.260   1.377  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.033   1.271   0.029  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.170  -0.828   0.116  1.00  0.00           H  
HETATM   28  H   UNL     1       4.677  -0.746  -1.165  1.00  0.00           H  
HETATM   29  H   UNL     1       5.275   0.598  -0.163  1.00  0.00           H  
HETATM   30  H   UNL     1       5.213  -1.051   0.505  1.00  0.00           H  
CONECT    1   10    3    2   16                                       
CONECT    2    1   17                                                 
CONECT    3    1    5    4   18                                       
CONECT    4    3   13   19                                            
CONECT    5    3    7    6   20                                       
CONECT    6    5   21                                                 
CONECT    7    5    8    9   22                                       
CONECT    8    7   23                                                 
CONECT    9    7   11   10   24                                       
CONECT   10    1    9                                                 
CONECT   11    9   12   25   26                                       
CONECT   12   11   27                                                 
CONECT   13    4   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   28   29   30                                       
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
