COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.230   2.501  -0.119  1.00  0.00           C  
HETATM    2  C   UNL     1       0.320   0.580   1.152  1.00  0.00           C  
HETATM    3  C   UNL     1       2.747   0.039   1.388  1.00  0.00           C  
HETATM    4  C   UNL     1       4.868   0.461   0.129  1.00  0.00           C  
HETATM    5  C   UNL     1       5.328  -2.254  -0.146  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.802   0.865   0.150  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.140   1.462  -0.045  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.753   2.435  -1.161  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.386   3.789  -0.552  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.501   0.128  -0.645  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.165  -2.320  -1.746  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.367  -1.026   0.104  1.00  0.00           C  
HETATM   13  F   UNL     1       5.551  -3.580  -0.278  1.00  0.00           F  
HETATM   14  C   UNL     1       4.202  -1.805   0.523  1.00  0.00           C  
HETATM   15  C   UNL     1       6.224  -1.344  -0.679  1.00  0.00           C  
HETATM   16  C   UNL     1       5.995   0.014  -0.541  1.00  0.00           C  
HETATM   17  F   UNL     1       6.869   0.903  -1.060  1.00  0.00           F  
HETATM   18  C   UNL     1       3.973  -0.449   0.660  1.00  0.00           C  
HETATM   19  C   UNL     1       1.596   0.205   0.395  1.00  0.00           C  
HETATM   20  N   UNL     1       1.925   1.265  -0.562  1.00  0.00           N  
HETATM   21  O   UNL     1       2.145   2.760   1.062  1.00  0.00           O  
HETATM   22  C   UNL     1       2.681   3.559  -1.093  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.065  -0.503   2.002  1.00  0.00           O  
HETATM   24  N   UNL     1      -2.006   1.295   0.873  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.587   4.346   0.216  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.974   3.373   1.332  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.341   2.018   0.723  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.973   0.058  -1.943  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.699  -2.250  -0.446  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.304  -1.166  -2.493  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.547  -3.509   0.369  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.854  -4.724  -0.508  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.113  -3.607   0.892  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.519  -3.472   1.549  1.00  0.00           C  
HETATM   35  H   UNL     1       0.503   1.469   1.755  1.00  0.00           H  
HETATM   36  H   UNL     1       2.467  -0.686   2.152  1.00  0.00           H  
HETATM   37  H   UNL     1       2.962   0.998   1.859  1.00  0.00           H  
HETATM   38  H   UNL     1       4.691   1.520   0.240  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.487   1.653  -0.533  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.022  -0.040  -0.416  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.898   2.039  -1.708  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.595   2.559  -1.843  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.545   3.665   0.130  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.111   4.483  -1.347  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.424  -3.277  -2.175  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.003  -0.971   1.119  1.00  0.00           H  
HETATM   47  H   UNL     1       3.502  -2.514   0.939  1.00  0.00           H  
HETATM   48  H   UNL     1       7.103  -1.693  -1.201  1.00  0.00           H  
HETATM   49  H   UNL     1       1.439  -0.732  -0.140  1.00  0.00           H  
HETATM   50  H   UNL     1       1.924   1.077  -1.513  1.00  0.00           H  
HETATM   51  H   UNL     1       2.614   3.171  -2.109  1.00  0.00           H  
HETATM   52  H   UNL     1       2.042   4.437  -0.997  1.00  0.00           H  
HETATM   53  H   UNL     1       3.713   3.836  -0.876  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.244  -1.328   1.531  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.233   0.649   1.614  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.325   5.311   0.650  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.428   4.470  -0.466  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.132   3.249   2.013  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.829   3.769   1.879  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.182   2.142   0.041  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.616   1.325   1.518  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.082   0.960  -2.527  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.669  -1.220  -3.509  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.161  -4.750  -1.349  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.744  -5.635   0.081  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.876  -4.654  -0.881  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.923  -2.790   1.588  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.978  -4.559   1.405  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.416  -3.543   0.057  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.541  -3.402   1.176  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.410  -4.383   2.138  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.300  -2.606   2.174  1.00  0.00           H  
CONECT    1   20   21   21   22                                       
CONECT    2    6   19   23   35                                       
CONECT    3   18   19   36   37                                       
CONECT    4   16   16   18   38                                       
CONECT    5   13   14   15   15                                       
CONECT    6    2   24   39   40                                       
CONECT    7    8   10   24   27                                       
CONECT    8    7    9   41   42                                       
CONECT    9    8   25   43   44                                       
CONECT   10    7   12   12   28                                       
CONECT   11   29   29   30   45                                       
CONECT   12   10   10   29   46                                       
CONECT   13    5                                                      
CONECT   14    5   18   18   47                                       
CONECT   15    5    5   16   48                                       
CONECT   16    4    4   15   17                                       
CONECT   17   16                                                      
CONECT   18    3    4   14   14                                       
CONECT   19    2    3   20   49                                       
CONECT   20    1   19   50                                            
CONECT   21    1    1                                                 
CONECT   22    1   51   52   53                                       
CONECT   23    2   54                                                 
CONECT   24    6    7   55                                            
CONECT   25    9   26   56   57                                       
CONECT   26   25   27   58   59                                       
CONECT   27    7   26   60   61                                       
CONECT   28   10   30   30   62                                       
CONECT   29   11   11   12   31                                       
CONECT   30   11   28   28   63                                       
CONECT   31   29   32   33   34                                       
CONECT   32   31   64   65   66                                       
CONECT   33   31   67   68   69                                       
CONECT   34   31   70   71   72                                       
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   30                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   33                                                      
CONECT   70   34                                                      
CONECT   71   34                                                      
CONECT   72   34                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
