COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1     -40.921 177.485  70.201  1.00  0.00           N  
HETATM    2  C   UNL     1     -40.798 176.348  69.472  1.00  0.00           C  
HETATM    3  N   UNL     1     -40.251 175.283  69.975  1.00  0.00           N  
HETATM    4  C   UNL     1     -39.818 175.151  71.264  1.00  0.00           C  
HETATM    5  N   UNL     1     -40.223 175.958  72.220  1.00  0.00           N  
HETATM    6  C   UNL     1     -39.855 175.833  73.488  1.00  0.00           C  
HETATM    7  C   UNL     1     -39.035 174.805  73.881  1.00  0.00           C  
HETATM    8 CL   UNL     1     -38.566 174.689  75.515  1.00  0.00          Cl  
HETATM    9  C   UNL     1     -38.544 173.857  72.959  1.00  0.00           C  
HETATM   10  C   UNL     1     -37.686 172.786  73.336  1.00  0.00           C  
HETATM   11  C   UNL     1     -37.263 171.935  72.395  1.00  0.00           C  
HETATM   12  C   UNL     1     -37.640 172.120  71.065  1.00  0.00           C  
HETATM   13  C   UNL     1     -38.468 173.125  70.666  1.00  0.00           C  
HETATM   14  C   UNL     1     -38.929 174.024  71.613  1.00  0.00           C  
HETATM   15  S   UNL     1     -36.992 171.005  69.889  1.00  0.00           S  
HETATM   16  O   UNL     1     -37.285 171.448  68.558  1.00  0.00           O  
HETATM   17  O   UNL     1     -35.708 170.924  70.380  1.00  0.00           O  
HETATM   18  N   UNL     1     -37.840 169.568  70.146  1.00  0.00           N  
HETATM   19  C   UNL     1     -37.495 168.464  71.063  1.00  0.00           C  
HETATM   20  C   UNL     1     -38.861 167.872  71.496  1.00  0.00           C  
HETATM   21  C   UNL     1     -39.758 168.007  70.238  1.00  0.00           C  
HETATM   22  C   UNL     1     -39.112 169.201  69.514  1.00  0.00           C  
HETATM   23  C   UNL     1     -38.899 168.819  68.083  1.00  0.00           C  
HETATM   24  O   UNL     1     -37.916 168.227  67.648  1.00  0.00           O  
HETATM   25  O   UNL     1     -39.893 169.186  67.292  1.00  0.00           O  
HETATM   26  N   UNL     1     -41.192 176.267  68.189  1.00  0.00           N  
HETATM   27  H   UNL     1     -40.545 177.363  71.120  1.00  0.00           H  
HETATM   28  H   UNL     1     -41.333 178.332  69.865  1.00  0.00           H  
HETATM   29  H   UNL     1     -41.588 177.132  67.881  1.00  0.00           H  
HETATM   30  H   UNL     1     -41.101 175.450  67.619  1.00  0.00           H  
HETATM   31  H   UNL     1     -40.204 176.547  74.219  1.00  0.00           H  
HETATM   32  H   UNL     1     -37.382 172.663  74.365  1.00  0.00           H  
HETATM   33  H   UNL     1     -36.629 171.104  72.665  1.00  0.00           H  
HETATM   34  H   UNL     1     -38.760 173.219  69.630  1.00  0.00           H  
HETATM   35  H   UNL     1     -36.878 167.707  70.557  1.00  0.00           H  
HETATM   36  H   UNL     1     -36.902 168.809  71.923  1.00  0.00           H  
HETATM   37  H   UNL     1     -39.774 170.078  69.576  1.00  0.00           H  
HETATM   38  H   UNL     1     -38.759 166.820  71.801  1.00  0.00           H  
HETATM   39  H   UNL     1     -39.284 168.394  72.367  1.00  0.00           H  
HETATM   40  H   UNL     1     -39.747 167.095  69.623  1.00  0.00           H  
HETATM   41  H   UNL     1     -40.823 168.155  70.469  1.00  0.00           H  
HETATM   42  H   UNL     1     -39.703 168.920  66.400  1.00  0.00           H  
CONECT    1    2   27   28                                            
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5   14   14                                       
CONECT    5    4    6    6                                            
CONECT    6    5    5    7   31                                       
CONECT    7    6    8    9    9                                       
CONECT    8    7                                                      
CONECT    9    7    7   10   14                                       
CONECT   10    9   11   11   32                                       
CONECT   11   10   10   12   33                                       
CONECT   12   11   13   13   15                                       
CONECT   13   12   12   14   34                                       
CONECT   14    4    4    9   13                                       
CONECT   15   12   16   16   17                                       
CONECT   15   17   18                                                 
CONECT   16   15   15                                                 
CONECT   17   15   15                                                 
CONECT   18   15   19   22                                            
CONECT   19   18   20   35   36                                       
CONECT   20   19   21   38   39                                       
CONECT   21   20   22   40   41                                       
CONECT   22   18   21   23   37                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   42                                                 
CONECT   26    2   29   30                                            
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29   26                                                      
CONECT   30   26                                                      
CONECT   31    6                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   22                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
