COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.401   3.780  -0.155  1.00  0.00           C  
HETATM    2  C   UNL     1       4.780   0.093   0.271  1.00  0.00           C  
HETATM    3  C   UNL     1       5.826  -1.736  -1.037  1.00  0.00           C  
HETATM    4  C   UNL     1       7.106  -3.455  -2.079  1.00  0.00           C  
HETATM    5  C   UNL     1       6.991  -4.459  -3.228  1.00  0.00           C  
HETATM    6  C   UNL     1       5.423   5.298   1.275  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.015  -4.373   1.072  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.221  -2.556  -0.273  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.796  -3.529   1.388  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.430  -0.046   1.143  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.032  -0.372   0.860  1.00  0.00           C  
HETATM   12  C   UNL     1       0.090  -1.637   0.009  1.00  0.00           C  
HETATM   13  C   UNL     1       3.528   0.960   0.418  1.00  0.00           C  
HETATM   14  C   UNL     1       3.763   2.017   1.498  1.00  0.00           C  
HETATM   15  C   UNL     1       4.862   2.978   1.041  1.00  0.00           C  
HETATM   16  C   UNL     1       4.592  -0.882  -0.892  1.00  0.00           C  
HETATM   17  C   UNL     1       1.133   0.540   0.573  1.00  0.00           C  
HETATM   18  C   UNL     1       5.137   4.042   2.129  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.227  -3.440   0.070  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.006  -2.602   0.384  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.799  -4.414   1.732  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.717   0.662   0.808  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.280   0.107  -0.502  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.738   2.347  -1.631  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.484   2.741  -2.067  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.366   2.016  -1.701  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.500   0.897  -0.900  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.751   0.503  -0.464  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.870   1.230  -0.825  1.00  0.00           C  
HETATM   30  F   UNL     1      -3.997  -5.238   1.407  1.00  0.00           F  
HETATM   31  F   UNL     1      -8.831   3.056  -1.989  1.00  0.00           F  
HETATM   32  N   UNL     1      -1.283   0.317   0.535  1.00  0.00           N  
HETATM   33  N   UNL     1       2.392   0.116   0.798  1.00  0.00           N  
HETATM   34  N   UNL     1       4.727   5.075   0.003  1.00  0.00           N  
HETATM   35  N   UNL     1      -4.689   0.448   1.889  1.00  0.00           N  
HETATM   36  O   UNL     1      -2.426  -0.944   1.959  1.00  0.00           O  
HETATM   37  O   UNL     1       3.825   3.322  -1.119  1.00  0.00           O  
HETATM   38  O   UNL     1       5.887  -2.669  -1.999  1.00  0.00           O  
HETATM   39  O   UNL     1       6.759  -1.580  -0.285  1.00  0.00           O  
HETATM   40  O   UNL     1       0.937   1.656   0.140  1.00  0.00           O  
HETATM   41  H   UNL     1       5.642   0.730   0.076  1.00  0.00           H  
HETATM   42  H   UNL     1       4.944  -0.467   1.192  1.00  0.00           H  
HETATM   43  H   UNL     1       7.255  -3.991  -1.142  1.00  0.00           H  
HETATM   44  H   UNL     1       7.953  -2.793  -2.258  1.00  0.00           H  
HETATM   45  H   UNL     1       7.906  -5.048  -3.288  1.00  0.00           H  
HETATM   46  H   UNL     1       6.144  -5.120  -3.049  1.00  0.00           H  
HETATM   47  H   UNL     1       6.842  -3.923  -4.165  1.00  0.00           H  
HETATM   48  H   UNL     1       5.035   6.190   1.766  1.00  0.00           H  
HETATM   49  H   UNL     1       6.495   5.396   1.106  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.386  -1.828  -1.054  1.00  0.00           H  
HETATM   51  H   UNL     1       0.153  -3.562   1.903  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.030  -0.643   1.916  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.002  -1.376  -1.046  1.00  0.00           H  
HETATM   54  H   UNL     1       1.059  -2.102   0.185  1.00  0.00           H  
HETATM   55  H   UNL     1       3.313   1.451  -0.531  1.00  0.00           H  
HETATM   56  H   UNL     1       2.841   2.574   1.668  1.00  0.00           H  
HETATM   57  H   UNL     1       4.069   1.529   2.424  1.00  0.00           H  
HETATM   58  H   UNL     1       5.773   2.428   0.804  1.00  0.00           H  
HETATM   59  H   UNL     1       3.730  -1.520  -0.697  1.00  0.00           H  
HETATM   60  H   UNL     1       4.429  -0.322  -1.813  1.00  0.00           H  
HETATM   61  H   UNL     1       6.005   3.774   2.731  1.00  0.00           H  
HETATM   62  H   UNL     1       4.259   4.189   2.757  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.176  -3.404  -0.443  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.635  -5.138   2.517  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.526   1.730   0.698  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.525   0.185  -1.284  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.554  -0.939  -0.364  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.380   3.615  -2.693  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.388   2.323  -2.041  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.854  -0.372   0.161  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.847   0.922  -0.484  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.287   1.035  -0.118  1.00  0.00           H  
HETATM   73  H   UNL     1       2.546  -0.747   1.212  1.00  0.00           H  
HETATM   74  H   UNL     1       4.523   5.773  -0.640  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.539   0.966   1.719  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.883  -0.535   2.011  1.00  0.00           H  
CONECT    1   34   37   37   15                                       
CONECT    2   13   16   41   42                                       
CONECT    3   39   39   38   16                                       
CONECT    4    5   38   43   44                                       
CONECT    5    4   45   46   47                                       
CONECT    6   34   18   48   49                                       
CONECT    7   19   19   21   30                                       
CONECT    8   20   20   19   50                                       
CONECT    9   20   21   21   51                                       
CONECT   10   22   36   36   32                                       
CONECT   11   17   32   12   52                                       
CONECT   12   11   20   53   54                                       
CONECT   13   14    2   33   55                                       
CONECT   14   15   13   56   57                                       
CONECT   15   18    1   14   58                                       
CONECT   16    3    2   59   60                                       
CONECT   17   40   40   33   11                                       
CONECT   18    6   15   61   62                                       
CONECT   19    8    7    7   63                                       
CONECT   20   12    8    8    9                                       
CONECT   21    9    9    7   64                                       
CONECT   22   35   10   23   65                                       
CONECT   23   22   27   66   67                                       
CONECT   24   25   25   29   31                                       
CONECT   25   26   24   24   68                                       
CONECT   26   27   27   25   69                                       
CONECT   27   23   26   26   28                                       
CONECT   28   27   29   29   70                                       
CONECT   29   28   28   24   71                                       
CONECT   30    7                                                      
CONECT   31   24                                                      
CONECT   32   10   11   72                                            
CONECT   33   13   17   73                                            
CONECT   34    6    1   74                                            
CONECT   35   22   75   76                                            
CONECT   36   10   10                                                 
CONECT   37    1    1                                                 
CONECT   38    4    3                                                 
CONECT   39    3    3                                                 
CONECT   40   17   17                                                 
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   14                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   18                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   23                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   34                                                      
CONECT   75   35                                                      
CONECT   76   35                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
