COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.921  -0.787  -0.589  1.00  0.00           C  
HETATM    2  C   UNL     1       5.651  -0.037  -0.997  1.00  0.00           C  
HETATM    3  C   UNL     1       3.943   1.312  -0.041  1.00  0.00           C  
HETATM    4  C   UNL     1       3.378   1.393  -1.305  1.00  0.00           C  
HETATM    5  C   UNL     1       2.215   2.115  -1.495  1.00  0.00           C  
HETATM    6  C   UNL     1       1.615   2.755  -0.427  1.00  0.00           C  
HETATM    7  O   UNL     1       6.580  -1.850   0.303  1.00  0.00           O  
HETATM    8  C   UNL     1       2.176   2.675   0.834  1.00  0.00           C  
HETATM    9  C   UNL     1       3.339   1.955   1.030  1.00  0.00           C  
HETATM   10  C   UNL     1       0.347   3.542  -0.638  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.843   2.639  -0.440  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.179   2.408  -0.316  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.964   0.980  -0.081  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.642   0.506  -0.054  1.00  0.00           C  
HETATM   15  O   UNL     1       5.084   0.598   0.150  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.302   2.879  -0.355  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.808  -0.124   0.138  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.085   3.185  -0.488  1.00  0.00           N  
HETATM   19  C   UNL     1      -5.314  -0.086   0.190  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.885  -0.996  -0.899  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.789  -0.572   1.561  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.626  -1.708   0.286  1.00  0.00           C  
HETATM   23  C   UNL     1       0.380  -1.457   1.212  1.00  0.00           C  
HETATM   24  C   UNL     1       1.450  -2.325   1.320  1.00  0.00           C  
HETATM   25  C   UNL     1       1.521  -3.442   0.507  1.00  0.00           C  
HETATM   26  N   UNL     1      -3.065  -1.186   0.291  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.633   1.371  -0.237  1.00  0.00           N  
HETATM   28  C   UNL     1       0.523  -3.694  -0.415  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.550  -2.831  -0.529  1.00  0.00           C  
HETATM   30  N   UNL     1      -1.715  -0.833   0.178  1.00  0.00           N  
HETATM   31 CL   UNL     1       0.291  -0.055   2.232  1.00  0.00          Cl  
HETATM   32 CL   UNL     1      -1.804  -3.149  -1.687  1.00  0.00          Cl  
HETATM   33  H   UNL     1       7.402  -1.198  -1.477  1.00  0.00           H  
HETATM   34  H   UNL     1       7.604  -0.100  -0.091  1.00  0.00           H  
HETATM   35  H   UNL     1       5.898   0.716  -1.745  1.00  0.00           H  
HETATM   36  H   UNL     1       4.932  -0.742  -1.415  1.00  0.00           H  
HETATM   37  H   UNL     1       3.847   0.894  -2.140  1.00  0.00           H  
HETATM   38  H   UNL     1       1.775   2.178  -2.479  1.00  0.00           H  
HETATM   39  H   UNL     1       7.339  -2.370   0.603  1.00  0.00           H  
HETATM   40  H   UNL     1       1.706   3.177   1.667  1.00  0.00           H  
HETATM   41  H   UNL     1       3.774   1.889   2.016  1.00  0.00           H  
HETATM   42  H   UNL     1       0.304   4.361   0.080  1.00  0.00           H  
HETATM   43  H   UNL     1       0.333   3.945  -1.650  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.188   4.136  -0.646  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.657   0.935   0.027  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.542  -2.018  -0.736  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.974  -0.969  -0.861  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.547  -0.650  -1.876  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.382   0.076   2.337  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.878  -0.544   1.599  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.445  -1.593   1.724  1.00  0.00           H  
HETATM   52  H   UNL     1       2.231  -2.131   2.040  1.00  0.00           H  
HETATM   53  H   UNL     1       2.359  -4.118   0.594  1.00  0.00           H  
HETATM   54  H   UNL     1       0.582  -4.567  -1.049  1.00  0.00           H  
CONECT    1    2    7   33   34                                       
CONECT    2   15    1   35   36                                       
CONECT    3    4    4    9   15                                       
CONECT    4    5    3    3   37                                       
CONECT    5    6    6    4   38                                       
CONECT    6   10    5    5    8                                       
CONECT    7    1   39                                                 
CONECT    8    6    9    9   40                                       
CONECT    9    8    8    3   41                                       
CONECT   10   11    6   42   43                                       
CONECT   11   18   27   27   10                                       
CONECT   12   16   16   13   18                                       
CONECT   13   17   12   14   14                                       
CONECT   14   13   13   30   27                                       
CONECT   15    3    2                                                 
CONECT   16   12   12                                                 
CONECT   17   19   26   26   13                                       
CONECT   18   12   11   44                                            
CONECT   19   21   20   17   45                                       
CONECT   20   19   46   47   48                                       
CONECT   21   19   49   50   51                                       
CONECT   22   30   23   23   29                                       
CONECT   23   31   22   22   24                                       
CONECT   24   23   25   25   52                                       
CONECT   25   24   24   28   53                                       
CONECT   26   17   17   30                                            
CONECT   27   14   11   11                                            
CONECT   28   29   29   25   54                                       
CONECT   29   22   32   28   28                                       
CONECT   30   26   14   22                                            
CONECT   31   23                                                      
CONECT   32   29                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   28                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
