COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.561  -0.700   0.121  1.00  0.00           C  
HETATM    2  C   UNL     1       6.849  -1.294   0.905  1.00  0.00           C  
HETATM    3  C   UNL     1       6.001   0.347  -0.823  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.340  -0.791  -1.586  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.757  -1.161  -1.543  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.194  -0.850  -0.239  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.042  -0.792   1.456  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.856  -1.925  -2.130  1.00  0.00           C  
HETATM    9  C   UNL     1       0.008   2.643   0.441  1.00  0.00           C  
HETATM   10  C   UNL     1       0.141   3.968   0.065  1.00  0.00           C  
HETATM   11  C   UNL     1       0.746   4.287  -1.136  1.00  0.00           C  
HETATM   12  C   UNL     1       1.218   3.283  -1.962  1.00  0.00           C  
HETATM   13  C   UNL     1       1.085   1.959  -1.586  1.00  0.00           C  
HETATM   14  C   UNL     1       0.485   1.639  -0.382  1.00  0.00           C  
HETATM   15  C   UNL     1       0.340   0.196   0.027  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.023  -0.306  -0.375  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.532  -1.100   0.104  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.367  -1.649  -0.873  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.121  -0.335   0.441  1.00  0.00           N  
HETATM   20  N   UNL     1      -3.598  -1.681  -2.429  1.00  0.00           N  
HETATM   21  O   UNL     1       1.345  -0.586  -0.621  1.00  0.00           O  
HETATM   22  O   UNL     1      -6.330  -1.041   1.763  1.00  0.00           O  
HETATM   23  O   UNL     1      -4.300  -0.315   2.291  1.00  0.00           O  
HETATM   24 CL   UNL     1      -0.751   2.241   1.950  1.00  0.00          Cl  
HETATM   25  C   UNL     1       3.559  -1.554  -0.663  1.00  0.00           C  
HETATM   26  C   UNL     1       4.842  -1.674   0.119  1.00  0.00           C  
HETATM   27  C   UNL     1       6.345  -2.398   1.488  1.00  0.00           C  
HETATM   28  N   UNL     1       5.117  -2.607   0.989  1.00  0.00           N  
HETATM   29  N   UNL     1       5.896  -0.834   0.036  1.00  0.00           N  
HETATM   30  H   UNL     1       2.981   0.292   0.285  1.00  0.00           H  
HETATM   31  H   UNL     1       2.357  -1.171   1.083  1.00  0.00           H  
HETATM   32  H   UNL     1       7.818  -0.853   1.090  1.00  0.00           H  
HETATM   33  H   UNL     1       6.429   0.061  -1.784  1.00  0.00           H  
HETATM   34  H   UNL     1       5.009   0.772  -0.979  1.00  0.00           H  
HETATM   35  H   UNL     1       6.642   1.088  -0.346  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.675  -0.894  -2.431  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.504  -2.349  -2.882  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.227   4.752   0.709  1.00  0.00           H  
HETATM   39  H   UNL     1       0.850   5.321  -1.430  1.00  0.00           H  
HETATM   40  H   UNL     1       1.690   3.533  -2.900  1.00  0.00           H  
HETATM   41  H   UNL     1       1.453   1.176  -2.231  1.00  0.00           H  
HETATM   42  H   UNL     1       0.454   0.112   1.108  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.403  -1.858  -0.649  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.138  -0.034   1.363  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.617  -0.823   2.660  1.00  0.00           H  
HETATM   46  H   UNL     1       3.139  -2.546  -0.827  1.00  0.00           H  
HETATM   47  H   UNL     1       3.763  -1.083  -1.625  1.00  0.00           H  
HETATM   48  H   UNL     1       6.841  -3.009   2.227  1.00  0.00           H  
CONECT    1   25   21   30   31                                       
CONECT    2   29   27   27   32                                       
CONECT    3   29   33   34   35                                       
CONECT    4    5   16   16   36                                       
CONECT    5    4   20   20    6                                       
CONECT    6    5   19   17   17                                       
CONECT    7   17   23   23   22                                       
CONECT    8   20   18   18   37                                       
CONECT    9   14   14   10   24                                       
CONECT   10   11   11    9   38                                       
CONECT   11   12   10   10   39                                       
CONECT   12   13   13   11   40                                       
CONECT   13   12   12   14   41                                       
CONECT   14   13   15    9    9                                       
CONECT   15   21   14   16   42                                       
CONECT   16    4    4   15   19                                       
CONECT   17    6    6   18    7                                       
CONECT   18    8    8   17   43                                       
CONECT   19   16    6   44                                            
CONECT   20    5    5    8                                            
CONECT   21    1   15                                                 
CONECT   22    7   45                                                 
CONECT   23    7    7                                                 
CONECT   24    9                                                      
CONECT   25   26    1   46   47                                       
CONECT   26   29   28   28   25                                       
CONECT   27    2    2   28   48                                       
CONECT   28   27   26   26                                            
CONECT   29    3    2   26                                            
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
