COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.910   1.124  -0.006  1.00  0.00           C  
HETATM    2  C   UNL     1       2.526   1.128  -0.022  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.493  -1.284   0.025  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.870  -1.270   0.007  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.550   1.229  -0.036  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.242   1.119  -0.042  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.306  -0.092   0.052  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.590   1.126   0.060  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.784  -0.081   0.033  1.00  0.00           C  
HETATM   10  C   UNL     1       3.825   3.497  -0.019  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.475   1.133   0.021  1.00  0.00           C  
HETATM   12  C   UNL     1       4.601  -0.098   0.002  1.00  0.00           C  
HETATM   13  C   UNL     1       6.072  -0.115   0.019  1.00  0.00           C  
HETATM   14  C   UNL     1       3.885  -1.301  -0.006  1.00  0.00           C  
HETATM   15  C   UNL     1       2.519  -1.285  -0.022  1.00  0.00           C  
HETATM   16  C   UNL     1       1.829  -0.073  -0.024  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.852   1.140   0.002  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.554  -0.060  -0.005  1.00  0.00           C  
HETATM   19  N   UNL     1       0.437  -0.068  -0.039  1.00  0.00           N  
HETATM   20  O   UNL     1       6.732  -1.290   0.026  1.00  0.00           O  
HETATM   21  O   UNL     1       6.691   0.931   0.026  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.705  -1.152   0.062  1.00  0.00           O  
HETATM   23  O   UNL     1      -7.911  -0.049  -0.024  1.00  0.00           O  
HETATM   24  O   UNL     1       4.596   2.294  -0.004  1.00  0.00           O  
HETATM   25 CL   UNL     1       1.638  -2.781  -0.032  1.00  0.00          Cl  
HETATM   26  H   UNL     1       1.988   2.065  -0.031  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.963  -2.225   0.039  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.419  -2.200   0.001  1.00  0.00           H  
HETATM   29  H   UNL     1      -9.632   1.094  -0.051  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.266   1.785   0.858  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.240   1.782  -0.922  1.00  0.00           H  
HETATM   32  H   UNL     1       0.298   2.050  -0.124  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.120   2.063   0.146  1.00  0.00           H  
HETATM   34  H   UNL     1       3.206   3.522  -0.916  1.00  0.00           H  
HETATM   35  H   UNL     1       3.187   3.531   0.864  1.00  0.00           H  
HETATM   36  H   UNL     1       4.494   4.358  -0.015  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.929   2.066   0.027  1.00  0.00           H  
HETATM   38  H   UNL     1       4.413  -2.243  -0.005  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.386   2.078  -0.007  1.00  0.00           H  
HETATM   40  H   UNL     1       7.699  -1.250   0.037  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.051  -0.906  -0.048  1.00  0.00           H  
CONECT    1   12   12    2   24                                       
CONECT    2   16   16    1   26                                       
CONECT    3    9    9    4   27                                       
CONECT    4    3   18   18   28                                       
CONECT    5   23   29   30   31                                       
CONECT    6   19    8    8   32                                       
CONECT    7   22   22    9    8                                       
CONECT    8    7    6    6   33                                       
CONECT    9    7    3    3   11                                       
CONECT   10   24   34   35   36                                       
CONECT   11    9   17   17   37                                       
CONECT   12   14   13    1    1                                       
CONECT   13   21   21   12   20                                       
CONECT   14   15   15   12   38                                       
CONECT   15   25   14   14   16                                       
CONECT   16   15   19    2    2                                       
CONECT   17   11   11   18   39                                       
CONECT   18    4    4   17   23                                       
CONECT   19   16    6   41                                            
CONECT   20   13   40                                                 
CONECT   21   13   13                                                 
CONECT   22    7    7                                                 
CONECT   23   18    5                                                 
CONECT   24    1   10                                                 
CONECT   25   15                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   19                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
