COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.495   2.269  -0.255  1.00  0.00           C  
HETATM    2  C   UNL     1       0.365   1.328   0.165  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.775   2.133   0.735  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.010   2.277   1.733  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.435   0.384   1.114  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.336  -0.299   0.419  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.663  -0.029   0.627  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.959   0.113   0.699  1.00  0.00           C  
HETATM    9  C   UNL     1      -9.375  -1.279  -0.845  1.00  0.00           C  
HETATM   10  C   UNL     1       6.575   0.004  -0.791  1.00  0.00           C  
HETATM   11  C   UNL     1       8.329  -1.401   0.048  1.00  0.00           C  
HETATM   12  C   UNL     1       4.192   0.503  -2.888  1.00  0.00           C  
HETATM   13  C   UNL     1       4.779   1.378  -1.779  1.00  0.00           C  
HETATM   14  C   UNL     1       3.689   2.294  -1.221  1.00  0.00           C  
HETATM   15  O   UNL     1       2.575   1.506  -0.796  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.691   3.341   0.799  1.00  0.00           O  
HETATM   17  N   UNL     1      -1.887   1.510   1.173  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.297   1.844   1.023  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.009   0.046   1.104  1.00  0.00           C  
HETATM   20  N   UNL     1      -6.769   0.486   1.142  1.00  0.00           N  
HETATM   21  C   UNL     1      -8.038  -0.829  -0.315  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.860  -1.344  -0.834  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.703  -0.927  -0.346  1.00  0.00           N  
HETATM   24  F   UNL     1      -9.278  -2.601  -1.293  1.00  0.00           F  
HETATM   25  F   UNL     1     -10.331  -1.200   0.173  1.00  0.00           F  
HETATM   26  F   UNL     1      -9.756  -0.454  -1.908  1.00  0.00           F  
HETATM   27  N   UNL     1       5.296   0.524  -0.706  1.00  0.00           N  
HETATM   28  C   UNL     1       7.029  -0.891   0.160  1.00  0.00           C  
HETATM   29  O   UNL     1       8.752  -2.194   0.876  1.00  0.00           O  
HETATM   30  N   UNL     1       9.111  -1.013  -0.979  1.00  0.00           N  
HETATM   31  N   UNL     1       8.632  -0.111  -1.935  1.00  0.00           N  
HETATM   32  C   UNL     1       7.427   0.378  -1.853  1.00  0.00           C  
HETATM   33  C   UNL     1       6.138  -1.312   1.301  1.00  0.00           C  
HETATM   34  F   UNL     1       6.134  -0.314   2.282  1.00  0.00           F  
HETATM   35  F   UNL     1       4.836  -1.506   0.828  1.00  0.00           F  
HETATM   36  F   UNL     1       6.617  -2.505   1.851  1.00  0.00           F  
HETATM   37  H   UNL     1       1.128   2.964  -1.010  1.00  0.00           H  
HETATM   38  H   UNL     1       1.844   2.828   0.613  1.00  0.00           H  
HETATM   39  H   UNL     1       0.016   0.769  -0.704  1.00  0.00           H  
HETATM   40  H   UNL     1       0.732   0.633   0.920  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.095   2.075   2.801  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.843   3.342   1.571  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.495  -1.377   0.457  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.304   0.027  -0.621  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.857   0.536   1.123  1.00  0.00           H  
HETATM   46  H   UNL     1       3.381  -0.102  -2.483  1.00  0.00           H  
HETATM   47  H   UNL     1       3.807   1.138  -3.686  1.00  0.00           H  
HETATM   48  H   UNL     1       4.969  -0.150  -3.286  1.00  0.00           H  
HETATM   49  H   UNL     1       5.590   1.982  -2.184  1.00  0.00           H  
HETATM   50  H   UNL     1       4.083   2.853  -0.372  1.00  0.00           H  
HETATM   51  H   UNL     1       3.367   2.989  -1.996  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.154   2.320   1.500  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.252   2.140  -0.025  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.998  -0.370   2.111  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.181  -0.364   0.526  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.887  -2.076  -1.627  1.00  0.00           H  
HETATM   57  H   UNL     1       4.741   0.323   0.064  1.00  0.00           H  
HETATM   58  H   UNL     1      10.011  -1.365  -1.058  1.00  0.00           H  
HETATM   59  H   UNL     1       7.078   1.073  -2.602  1.00  0.00           H  
CONECT    1   15    2   37   38                                       
CONECT    2    1    3   39   40                                       
CONECT    3    2   17   16   16                                       
CONECT    4   17   18   41   42                                       
CONECT    5   18    7    6                                            
CONECT    6   19    5   43   44                                       
CONECT    7   23    5   20   20                                       
CONECT    8   21   21   20   45                                       
CONECT    9   24   21   26   25                                       
CONECT   10   28   28   32   27                                       
CONECT   11   29   29   30   28                                       
CONECT   12   13   46   47   48                                       
CONECT   13   27   12   14   49                                       
CONECT   14   13   15   50   51                                       
CONECT   15   14    1                                                 
CONECT   16    3    3                                                 
CONECT   17    4    3   19                                            
CONECT   18    4    5   52   53                                       
CONECT   19   17    6   54   55                                       
CONECT   20    7    7    8                                            
CONECT   21   22    9    8    8                                       
CONECT   22   23   23   21   56                                       
CONECT   23   22   22    7                                            
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26    9                                                      
CONECT   27   10   13   57                                            
CONECT   28   11   33   10   10                                       
CONECT   29   11   11                                                 
CONECT   30   11   31   58                                            
CONECT   31   30   32   32                                            
CONECT   32   31   31   10   59                                       
CONECT   33   36   28   35   34                                       
CONECT   34   33                                                      
CONECT   35   33                                                      
CONECT   36   33                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   22                                                      
CONECT   57   27                                                      
CONECT   58   30                                                      
CONECT   59   32                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
