COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.722  -1.747   1.008  1.00  0.00           C  
HETATM    2  C   UNL     1       2.693  -1.046   0.231  1.00  0.00           C  
HETATM    3  C   UNL     1       2.842   0.123  -0.496  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.736  -1.720  -1.009  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.870  -1.250  -0.199  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.103  -1.596  -1.056  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.781   0.238   0.024  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.412   2.440  -0.844  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.123   5.376  -0.406  1.00  0.00           O  
HETATM   10  O   UNL     1      -3.838   5.075   1.928  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.898   2.123   1.499  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.979   0.757   1.289  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.814  -2.596   0.161  1.00  0.00           C  
HETATM   14  C   UNL     1       1.283  -1.443   0.055  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.650  -3.748   0.657  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.712  -3.977   2.168  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.916  -4.937   1.280  1.00  0.00           C  
HETATM   18  C   UNL     1       4.093   0.894  -0.624  1.00  0.00           C  
HETATM   19  C   UNL     1       5.256   0.456   0.014  1.00  0.00           C  
HETATM   20  C   UNL     1       6.422   1.181  -0.108  1.00  0.00           C  
HETATM   21  C   UNL     1       6.441   2.344  -0.863  1.00  0.00           C  
HETATM   22  C   UNL     1       5.290   2.784  -1.498  1.00  0.00           C  
HETATM   23  F   UNL     1      -4.092   2.631   2.736  1.00  0.00           F  
HETATM   24  C   UNL     1      -3.616   2.974   0.428  1.00  0.00           C  
HETATM   25  B   UNL     1      -3.523   4.524   0.657  1.00  0.00           B  
HETATM   26  C   UNL     1      -3.496   1.078  -1.040  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.540  -2.218  -2.247  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.206  -2.251  -2.146  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.487  -2.720  -3.006  1.00  0.00           O  
HETATM   30  C   UNL     1      -1.386  -1.623  -0.654  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.628  -0.559  -1.116  1.00  0.00           C  
HETATM   32  C   UNL     1       0.712  -0.458  -0.767  1.00  0.00           C  
HETATM   33  O   UNL     1       1.670   0.444  -1.067  1.00  0.00           O  
HETATM   34  C   UNL     1       0.514  -2.509   0.515  1.00  0.00           C  
HETATM   35  N   UNL     1       3.902  -1.449   2.310  1.00  0.00           N  
HETATM   36  C   UNL     1       4.930  -2.149   3.086  1.00  0.00           C  
HETATM   37  O   UNL     1       4.409  -2.600   0.478  1.00  0.00           O  
HETATM   38  C   UNL     1       4.120   2.064  -1.388  1.00  0.00           C  
HETATM   39  F   UNL     1       7.587   3.051  -0.980  1.00  0.00           F  
HETATM   40  H   UNL     1      -3.905  -1.779   0.754  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.750  -2.296  -0.529  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.651  -0.692  -1.320  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.190   3.093  -1.675  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.997   4.920  -1.250  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.751   6.037   1.972  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.196   0.097   2.115  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.550  -3.959   0.079  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.147  -3.295   2.804  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.652  -4.339   2.585  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.333  -5.930   1.112  1.00  0.00           H  
HETATM   51  H   UNL     1       0.171  -4.886   1.332  1.00  0.00           H  
HETATM   52  H   UNL     1       5.242  -0.450   0.603  1.00  0.00           H  
HETATM   53  H   UNL     1       7.321   0.843   0.384  1.00  0.00           H  
HETATM   54  H   UNL     1       5.312   3.691  -2.085  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.337   0.665  -2.025  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.080   0.191  -1.748  1.00  0.00           H  
HETATM   57  H   UNL     1       0.958  -3.264   1.147  1.00  0.00           H  
HETATM   58  H   UNL     1       3.352  -0.772   2.734  1.00  0.00           H  
HETATM   59  H   UNL     1       5.907  -1.971   2.637  1.00  0.00           H  
HETATM   60  H   UNL     1       4.927  -1.777   4.110  1.00  0.00           H  
HETATM   61  H   UNL     1       4.719  -3.218   3.086  1.00  0.00           H  
HETATM   62  H   UNL     1       3.226   2.405  -1.888  1.00  0.00           H  
CONECT    1   35   37   37    2                                       
CONECT    2    1   14    3    3                                       
CONECT    3    2    2   18   33                                       
CONECT    4   30    5   28                                            
CONECT    5    7    4    6   40                                       
CONECT    6    5   27   41   42                                       
CONECT    7   12   12   26    5                                       
CONECT    8   24   26   26   43                                       
CONECT    9   25   44                                                 
CONECT   10   25   45                                                 
CONECT   11   23   24   24   12                                       
CONECT   12   11    7    7   46                                       
CONECT   13   34   15   30   30                                       
CONECT   14    2   34   34   32                                       
CONECT   15   17   16   13   47                                       
CONECT   16   17   15   48   49                                       
CONECT   17   16   15   50   51                                       
CONECT   18   19    3   38   38                                       
CONECT   19   20   20   18   52                                       
CONECT   20   19   19   21   53                                       
CONECT   21   20   39   22   22                                       
CONECT   22   21   21   38   54                                       
CONECT   23   11                                                      
CONECT   24   25   11   11    8                                       
CONECT   25    9   10   24                                            
CONECT   26    8    8    7   55                                       
CONECT   27   28    6                                                 
CONECT   28    4   29   29   27                                       
CONECT   29   28   28                                                 
CONECT   30   13   13   31    4                                       
CONECT   31   32   32   30   56                                       
CONECT   32   14   33   31   31                                       
CONECT   33    3   32                                                 
CONECT   34   14   14   13   57                                       
CONECT   35   36    1   58                                            
CONECT   36   35   59   60   61                                       
CONECT   37    1    1                                                 
CONECT   38   18   18   22   62                                       
CONECT   39   21                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   26                                                      
CONECT   56   31                                                      
CONECT   57   34                                                      
CONECT   58   35                                                      
CONECT   59   36                                                      
CONECT   60   36                                                      
CONECT   61   36                                                      
CONECT   62   38                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
