COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.512   1.083   0.828  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.389   1.722  -0.032  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.931   2.703  -0.894  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.594   3.051  -0.901  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.175   1.420   0.832  1.00  0.00           C  
HETATM    6  N   UNL     1       1.108   4.044   0.061  1.00  0.00           N  
HETATM    7  C   UNL     1       2.386   4.385   0.062  1.00  0.00           C  
HETATM    8  N   UNL     1       3.359   3.509  -0.030  1.00  0.00           N  
HETATM    9  C   UNL     1       3.089   2.200  -0.132  1.00  0.00           C  
HETATM   10  C   UNL     1       1.733   1.782  -0.138  1.00  0.00           C  
HETATM   11  C   UNL     1       1.422   0.421  -0.242  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.031  -4.735  -2.221  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.184  -3.631  -0.295  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.060  -1.306   1.052  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.397  -2.402   1.586  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.459  -3.602   0.893  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.021   0.020   1.768  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.705   2.408  -0.034  1.00  0.00           C  
HETATM   19  C   UNL     1       0.729   2.775  -0.035  1.00  0.00           C  
HETATM   20  C   UNL     1       2.425  -0.495  -0.338  1.00  0.00           C  
HETATM   21  C   UNL     1       3.766  -0.094  -0.333  1.00  0.00           C  
HETATM   22  C   UNL     1       4.103   1.241  -0.232  1.00  0.00           C  
HETATM   23  C   UNL     1       4.203  -2.405  -0.530  1.00  0.00           C  
HETATM   24  C   UNL     1       5.338  -3.419  -0.697  1.00  0.00           C  
HETATM   25  C   UNL     1       6.821  -1.989   0.524  1.00  0.00           C  
HETATM   26  C   UNL     1       5.701  -0.961   0.703  1.00  0.00           C  
HETATM   27  F   UNL     1      -1.146   4.008  -1.743  1.00  0.00           F  
HETATM   28  N   UNL     1      -3.785  -2.533  -0.725  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.724  -1.425  -0.080  1.00  0.00           N  
HETATM   30  N   UNL     1       4.772  -1.053  -0.432  1.00  0.00           N  
HETATM   31  O   UNL     1      -3.270  -4.780  -1.012  1.00  0.00           O  
HETATM   32  O   UNL     1       6.248  -3.293   0.399  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.151  -0.074   2.898  1.00  0.00           O  
HETATM   34 CL   UNL     1      -5.071   1.290  -0.030  1.00  0.00          Cl  
HETATM   35  H   UNL     1      -3.620   3.198  -1.563  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.493   0.920   1.503  1.00  0.00           H  
HETATM   37  H   UNL     1       2.641   5.431   0.143  1.00  0.00           H  
HETATM   38  H   UNL     1       0.391   0.099  -0.247  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.060  -4.455  -1.992  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.596  -4.000  -2.897  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.019  -5.717  -2.694  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.848  -2.322   2.512  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.961  -4.485   1.264  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.025   0.282   2.102  1.00  0.00           H  
HETATM   45  H   UNL     1       2.182  -1.545  -0.419  1.00  0.00           H  
HETATM   46  H   UNL     1       5.140   1.542  -0.229  1.00  0.00           H  
HETATM   47  H   UNL     1       3.538  -2.458  -1.392  1.00  0.00           H  
HETATM   48  H   UNL     1       3.642  -2.631   0.377  1.00  0.00           H  
HETATM   49  H   UNL     1       4.925  -4.428  -0.713  1.00  0.00           H  
HETATM   50  H   UNL     1       5.864  -3.226  -1.632  1.00  0.00           H  
HETATM   51  H   UNL     1       7.391  -1.754  -0.375  1.00  0.00           H  
HETATM   52  H   UNL     1       7.481  -1.963   1.392  1.00  0.00           H  
HETATM   53  H   UNL     1       5.165  -1.164   1.630  1.00  0.00           H  
HETATM   54  H   UNL     1       6.130   0.041   0.742  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.239  -0.304   2.674  1.00  0.00           H  
CONECT    1   17    5    5    2                                       
CONECT    2    1    3    3   34                                       
CONECT    3    2    2    4   35                                       
CONECT    4   18   18   27    3                                       
CONECT    5    1    1   18   36                                       
CONECT    6   19   19    7                                            
CONECT    7    8    8    6   37                                       
CONECT    8    9    7    7                                            
CONECT    9   22   22   10    8                                       
CONECT   10   11   11    9   19                                       
CONECT   11   20   10   10   38                                       
CONECT   12   31   39   40   41                                       
CONECT   13   31   16   16   28                                       
CONECT   14   15   15   29   17                                       
CONECT   15   16   14   14   42                                       
CONECT   16   13   13   15   43                                       
CONECT   17   14    1   33   44                                       
CONECT   18   19    5    4    4                                       
CONECT   19   10   18    6    6                                       
CONECT   20   21   21   11   45                                       
CONECT   21   30   20   20   22                                       
CONECT   22   21    9    9   46                                       
CONECT   23   24   30   47   48                                       
CONECT   24   32   23   49   50                                       
CONECT   25   32   26   51   52                                       
CONECT   26   25   30   53   54                                       
CONECT   27    4                                                      
CONECT   28   13   29   29                                            
CONECT   29   28   28   14                                            
CONECT   30   26   23   21                                            
CONECT   31   12   13                                                 
CONECT   32   25   24                                                 
CONECT   33   17   55                                                 
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   33                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
