COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.123  -4.380   9.116  1.00  0.00           C  
HETATM    2  C   UNL     1       1.569  -4.663  10.390  1.00  0.00           C  
HETATM    3  C   UNL     1       1.648  -3.628  11.321  1.00  0.00           C  
HETATM    4  C   UNL     1       1.279  -2.333  10.957  1.00  0.00           C  
HETATM    5  C   UNL     1       0.831  -2.073   9.662  1.00  0.00           C  
HETATM    6  C   UNL     1       0.752  -3.109   8.731  1.00  0.00           C  
HETATM    7 CL   UNL     1       1.377  -1.055  12.106  1.00  0.00          Cl  
HETATM    8  C   UNL     1       1.039  -5.483   8.124  1.00  0.00           C  
HETATM    9  O   UNL     1       1.771  -6.462   8.251  1.00  0.00           O  
HETATM   10  N   UNL     1       0.096  -5.328   7.115  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.121  -6.319   6.096  1.00  0.00           C  
HETATM   12  C   UNL     1       0.768  -6.096   4.867  1.00  0.00           C  
HETATM   13  C   UNL     1       0.183  -2.295   3.000  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.578  -3.388   2.596  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.387  -4.628   3.205  1.00  0.00           C  
HETATM   16  C   UNL     1       0.564  -4.770   4.216  1.00  0.00           C  
HETATM   17  C   UNL     1       1.324  -3.671   4.617  1.00  0.00           C  
HETATM   18  C   UNL     1       1.133  -2.431   4.008  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.003  -1.079   2.402  1.00  0.00           O  
HETATM   20  C   UNL     1       0.250   0.073   3.206  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.675   0.016   4.418  1.00  0.00           C  
HETATM   22  C   UNL     1       0.006   1.311   2.347  1.00  0.00           C  
HETATM   23  C   UNL     1       1.712  -0.030   3.622  1.00  0.00           C  
HETATM   24  O   UNL     1       1.958   0.481   4.855  1.00  0.00           O  
HETATM   25  O   UNL     1       2.595  -0.522   2.930  1.00  0.00           O  
HETATM   26  H   UNL     1       1.859  -5.668  10.684  1.00  0.00           H  
HETATM   27  H   UNL     1       1.998  -3.845  12.327  1.00  0.00           H  
HETATM   28  H   UNL     1       0.541  -1.069   9.363  1.00  0.00           H  
HETATM   29  H   UNL     1       0.402  -2.895   7.724  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.517  -4.515   7.116  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.179  -6.262   5.820  1.00  0.00           H  
HETATM   32  H   UNL     1       0.062  -7.301   6.546  1.00  0.00           H  
HETATM   33  H   UNL     1       1.823  -6.193   5.175  1.00  0.00           H  
HETATM   34  H   UNL     1       0.603  -6.913   4.144  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.320  -3.284   1.810  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.984  -5.478   2.886  1.00  0.00           H  
HETATM   37  H   UNL     1       2.067  -3.772   5.404  1.00  0.00           H  
HETATM   38  H   UNL     1       1.729  -1.579   4.325  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.561   0.891   5.066  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.724  -0.047   4.108  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.470  -0.877   5.020  1.00  0.00           H  
HETATM   42  H   UNL     1       0.691   1.330   1.492  1.00  0.00           H  
HETATM   43  H   UNL     1       0.146   2.239   2.911  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.010   1.309   1.937  1.00  0.00           H  
HETATM   45  H   UNL     1       2.888   0.434   5.160  1.00  0.00           H  
CONECT    1    2    6    6    8                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4   27                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4    6   28                                       
CONECT    6    1    1    5   29                                       
CONECT    7    4                                                      
CONECT    8    1    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   30                                            
CONECT   11   10   12   31   32                                       
CONECT   12   11   16   33   34                                       
CONECT   13   14   18   18   19                                       
CONECT   14   13   15   15   35                                       
CONECT   15   14   14   16   36                                       
CONECT   16   12   15   17   17                                       
CONECT   17   16   16   18   37                                       
CONECT   18   13   13   17   38                                       
CONECT   19   13   20                                                 
CONECT   20   19   21   22   23                                       
CONECT   21   20   39   40   41                                       
CONECT   22   20   42   43   44                                       
CONECT   23   20   24   25   25                                       
CONECT   24   23   45                                                 
CONECT   25   23   23                                                 
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   21                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
