COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.262  -0.184   2.200  1.00  0.00           C  
HETATM    2  C   UNL     1       1.014  -0.088   3.038  1.00  0.00           C  
HETATM    3  N   UNL     1       1.077  -0.122   4.349  1.00  0.00           N  
HETATM    4  C   UNL     1      -0.013  -0.045   5.093  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.126  -0.069   6.470  1.00  0.00           N  
HETATM    6  C   UNL     1       1.072  -0.203   7.301  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.219   0.041   2.453  1.00  0.00           C  
HETATM    8  S   UNL     1      -1.266   0.102   3.900  1.00  0.00           S  
HETATM    9  C   UNL     1      -0.581   0.112   1.026  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.922   0.248   0.637  1.00  0.00           C  
HETATM   11  N   UNL     1       0.361   0.053   0.084  1.00  0.00           N  
HETATM   12  C   UNL     1       0.035   0.111  -1.197  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.223   0.239  -1.591  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.211   0.309  -0.711  1.00  0.00           C  
HETATM   15  N   UNL     1       1.036   0.041  -2.151  1.00  0.00           N  
HETATM   16  C   UNL     1       0.706  -0.010  -3.511  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.445  -0.667  -3.921  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.773  -0.713  -5.262  1.00  0.00           C  
HETATM   19  C   UNL     1       1.533   0.591  -4.450  1.00  0.00           C  
HETATM   20  C   UNL     1       1.206   0.540  -5.791  1.00  0.00           C  
HETATM   21  C   UNL     1       0.052  -0.112  -6.200  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.268  -0.162  -7.520  1.00  0.00           O  
HETATM   23  H   UNL     1       2.659   0.816   2.024  1.00  0.00           H  
HETATM   24  H   UNL     1       3.007  -0.783   2.723  1.00  0.00           H  
HETATM   25  H   UNL     1       2.024  -0.653   1.245  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.999   0.001   6.886  1.00  0.00           H  
HETATM   27  H   UNL     1       0.787  -0.203   8.353  1.00  0.00           H  
HETATM   28  H   UNL     1       1.578  -1.139   7.061  1.00  0.00           H  
HETATM   29  H   UNL     1       1.744   0.632   7.107  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.709   0.302   1.374  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.233   0.413  -1.045  1.00  0.00           H  
HETATM   32  H   UNL     1       1.967   0.028  -1.877  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.089  -1.136  -3.191  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.672  -1.221  -5.581  1.00  0.00           H  
HETATM   35  H   UNL     1       2.431   1.100  -4.132  1.00  0.00           H  
HETATM   36  H   UNL     1       1.849   1.007  -6.522  1.00  0.00           H  
HETATM   37  H   UNL     1       0.141  -0.961  -7.877  1.00  0.00           H  
CONECT    1    2   23   24   25                                       
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5    8                                       
CONECT    5    4    6   26                                            
CONECT    6    5   27   28   29                                       
CONECT    7    2    2    8    9                                       
CONECT    8    4    7                                                 
CONECT    9    7   10   10   11                                       
CONECT   10    9    9   14   30                                       
CONECT   11    9   12   12                                            
CONECT   12   11   11   13   15                                       
CONECT   13   12   14   14                                            
CONECT   14   10   13   13   31                                       
CONECT   15   12   16   32                                            
CONECT   16   15   17   17   19                                       
CONECT   17   16   16   18   33                                       
CONECT   18   17   21   21   34                                       
CONECT   19   16   20   20   35                                       
CONECT   20   19   19   21   36                                       
CONECT   21   18   18   20   22                                       
CONECT   22   21   37                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30   10                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
