COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.515   0.657   0.672  1.00  0.00           C  
HETATM    2  C   UNL     1       2.919   1.010   0.562  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.795  -1.040   1.254  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.308  -2.922  -0.637  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.715  -3.141  -1.813  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.562  -2.262  -2.238  1.00  0.00           C  
HETATM    7  C   UNL     1       3.405   0.366  -0.738  1.00  0.00           C  
HETATM    8  C   UNL     1       5.054  -1.407  -0.106  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.244   0.900   0.562  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.397   2.213   0.100  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.305   2.990  -0.166  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.026   2.480   0.021  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.858   1.162   0.486  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.968   0.372   0.756  1.00  0.00           C  
HETATM   15  C   UNL     1       1.330   2.734  -0.054  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.051   4.616  -0.724  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.435   0.074   0.845  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.821  -0.997  -0.079  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.875  -1.851   0.250  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.123  -1.159  -1.301  1.00  0.00           C  
HETATM   21  C   UNL     1       4.820  -0.123  -0.558  1.00  0.00           C  
HETATM   22  C   UNL     1       6.353  -1.856   0.060  1.00  0.00           C  
HETATM   23  C   UNL     1       7.415  -1.018  -0.229  1.00  0.00           C  
HETATM   24  C   UNL     1       7.179   0.266  -0.682  1.00  0.00           C  
HETATM   25  C   UNL     1       5.882   0.714  -0.846  1.00  0.00           C  
HETATM   26  N   UNL     1       0.100   3.242  -0.239  1.00  0.00           N  
HETATM   27  N   UNL     1       1.544   1.485   0.387  1.00  0.00           N  
HETATM   28  O   UNL     1       0.716  -0.472   1.075  1.00  0.00           O  
HETATM   29  O   UNL     1       2.292   3.438  -0.295  1.00  0.00           O  
HETATM   30  O   UNL     1      -5.096   0.283   1.846  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.520  -1.672   1.420  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.205  -0.421  -1.595  1.00  0.00           O  
HETATM   33 CL   UNL     1       6.648  -3.469   0.629  1.00  0.00          Cl  
HETATM   34  H   UNL     1       2.950   0.274   1.365  1.00  0.00           H  
HETATM   35  H   UNL     1       3.565   1.851   0.815  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.640  -1.708   0.407  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.932  -1.088   1.918  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.689  -1.345   1.798  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.132  -3.553  -0.338  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.057  -3.939  -2.455  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.702  -2.907  -2.417  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.829  -1.801  -3.189  1.00  0.00           H  
HETATM   43  H   UNL     1       2.760  -0.475  -0.991  1.00  0.00           H  
HETATM   44  H   UNL     1       3.375   1.102  -1.542  1.00  0.00           H  
HETATM   45  H   UNL     1       4.224  -2.059   0.123  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.388   2.616  -0.049  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.436   4.001  -0.523  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.096   5.298   0.125  1.00  0.00           H  
HETATM   49  H   UNL     1       0.800   4.875  -1.354  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.970   4.698  -1.304  1.00  0.00           H  
HETATM   51  H   UNL     1       8.429  -1.368  -0.100  1.00  0.00           H  
HETATM   52  H   UNL     1       8.009   0.920  -0.906  1.00  0.00           H  
HETATM   53  H   UNL     1       5.698   1.717  -1.201  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.245  -2.279   1.619  1.00  0.00           H  
CONECT    1   28   28   13   27                                       
CONECT    2   27    7   34   35                                       
CONECT    3   14   36   37   38                                       
CONECT    4   19    5    5   39                                       
CONECT    5    4    4    6   40                                       
CONECT    6    5   20   41   42                                       
CONECT    7    2   21   43   44                                       
CONECT    8   21   21   22   45                                       
CONECT    9   17   14   14   10                                       
CONECT   10    9   11   11   46                                       
CONECT   11   10   10   12   47                                       
CONECT   12   13   13   11   26                                       
CONECT   13   14    1   12   12                                       
CONECT   14    3    9    9   13                                       
CONECT   15   27   26   29   29                                       
CONECT   16   26   48   49   50                                       
CONECT   17   30   30   18    9                                       
CONECT   18   19   19   17   20                                       
CONECT   19   31   18   18    4                                       
CONECT   20   18   32   32    6                                       
CONECT   21    7    8    8   25                                       
CONECT   22    8   33   23   23                                       
CONECT   23   22   22   24   51                                       
CONECT   24   25   25   23   52                                       
CONECT   25   21   24   24   53                                       
CONECT   26   12   15   16                                            
CONECT   27    1    2   15                                            
CONECT   28    1    1                                                 
CONECT   29   15   15                                                 
CONECT   30   17   17                                                 
CONECT   31   19   54                                                 
CONECT   32   20   20                                                 
CONECT   33   22                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
