COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.731  -1.673  -1.321  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.020  -0.678  -0.645  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.909  -0.098  -1.311  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.600  -0.520  -2.528  1.00  0.00           N  
HETATM    5  N   UNL     1      -5.340  -2.032  -2.550  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.305  -1.465  -3.124  1.00  0.00           C  
HETATM    7  C   UNL     1       2.602   3.710   0.903  1.00  0.00           C  
HETATM    8  C   UNL     1       7.110   1.069   2.947  1.00  0.00           C  
HETATM    9  C   UNL     1       3.803   1.644  -2.018  1.00  0.00           C  
HETATM   10  C   UNL     1       4.904   0.999  -1.500  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.574  -0.410   0.669  1.00  0.00           C  
HETATM   12  C   UNL     1       5.145   2.152   1.888  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.758   2.891  -0.855  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.775   0.618  -1.167  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.525   3.479  -1.545  1.00  0.00           C  
HETATM   16  C   UNL     1       0.429   1.272  -1.848  1.00  0.00           C  
HETATM   17  C   UNL     1       5.098  -3.171  -0.031  1.00  0.00           C  
HETATM   18  C   UNL     1       7.972  -2.624   0.122  1.00  0.00           C  
HETATM   19  C   UNL     1       1.866   3.220  -1.824  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.371  -1.036   2.290  1.00  0.00           C  
HETATM   21  C   UNL     1       7.335  -0.206   0.170  1.00  0.00           C  
HETATM   22  C   UNL     1       6.137  -4.255   0.048  1.00  0.00           C  
HETATM   23  C   UNL     1       3.412   2.756   0.064  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.628  -1.139   0.984  1.00  0.00           C  
HETATM   25  C   UNL     1       6.218   1.318   1.855  1.00  0.00           C  
HETATM   26  C   UNL     1       3.064   2.521  -1.234  1.00  0.00           C  
HETATM   27  C   UNL     1       4.531   2.116   0.612  1.00  0.00           C  
HETATM   28  C   UNL     1       5.283   1.226  -0.180  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.018   1.483  -1.398  1.00  0.00           C  
HETATM   30  C   UNL     1       6.856  -1.631   0.454  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.483   0.008   2.164  1.00  0.00           C  
HETATM   32  F   UNL     1      -9.369  -0.375   1.152  1.00  0.00           F  
HETATM   33  F   UNL     1      -9.173   0.103   3.377  1.00  0.00           F  
HETATM   34  F   UNL     1      -7.922   1.250   1.848  1.00  0.00           F  
HETATM   35  N   UNL     1       7.818   0.872   3.813  1.00  0.00           N  
HETATM   36  N   UNL     1       7.446  -3.987   0.136  1.00  0.00           N  
HETATM   37  N   UNL     1      -3.162   0.893  -0.700  1.00  0.00           N  
HETATM   38  N   UNL     1       0.636   2.616  -1.294  1.00  0.00           N  
HETATM   39  N   UNL     1       6.311   0.749   0.600  1.00  0.00           N  
HETATM   40  O   UNL     1       5.777  -5.413   0.032  1.00  0.00           O  
HETATM   41  O   UNL     1       5.719  -1.928  -0.366  1.00  0.00           O  
HETATM   42  S   UNL     1      -7.058  -2.236  -0.315  1.00  0.00           S  
HETATM   43  H   UNL     1      -4.020  -1.781  -4.117  1.00  0.00           H  
HETATM   44  H   UNL     1       1.745   3.185   1.326  1.00  0.00           H  
HETATM   45  H   UNL     1       3.222   4.102   1.709  1.00  0.00           H  
HETATM   46  H   UNL     1       2.252   4.534   0.281  1.00  0.00           H  
HETATM   47  H   UNL     1       3.514   1.470  -3.043  1.00  0.00           H  
HETATM   48  H   UNL     1       5.473   0.319  -2.117  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.156   0.328   1.337  1.00  0.00           H  
HETATM   50  H   UNL     1       4.820   2.738   2.735  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.584   2.840   0.220  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.623   3.524  -1.055  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.939  -0.373  -1.590  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.586   0.531  -0.098  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.705   3.543  -2.618  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.329   4.476  -1.150  1.00  0.00           H  
HETATM   57  H   UNL     1       1.318   0.666  -1.674  1.00  0.00           H  
HETATM   58  H   UNL     1       0.245   1.346  -2.920  1.00  0.00           H  
HETATM   59  H   UNL     1       4.364  -3.427  -0.795  1.00  0.00           H  
HETATM   60  H   UNL     1       4.599  -3.077   0.934  1.00  0.00           H  
HETATM   61  H   UNL     1       8.373  -2.401  -0.867  1.00  0.00           H  
HETATM   62  H   UNL     1       8.767  -2.535   0.862  1.00  0.00           H  
HETATM   63  H   UNL     1       1.895   4.277  -1.559  1.00  0.00           H  
HETATM   64  H   UNL     1       1.883   3.118  -2.909  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.808  -2.004   2.536  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.681  -0.738   3.079  1.00  0.00           H  
HETATM   67  H   UNL     1       8.259  -0.018   0.717  1.00  0.00           H  
HETATM   68  H   UNL     1       7.515  -0.089  -0.898  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.230   1.538  -2.466  1.00  0.00           H  
HETATM   70  H   UNL     1       6.585  -1.723   1.506  1.00  0.00           H  
HETATM   71  H   UNL     1       8.069  -4.727   0.212  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.396   1.196   0.191  1.00  0.00           H  
CONECT    1   42    2    2    5                                       
CONECT    2   11    1    1    3                                       
CONECT    3    2   37    4    4                                       
CONECT    4    3    3    6                                            
CONECT    5    1    6    6                                            
CONECT    6    5    5    4   43                                       
CONECT    7   23   44   45   46                                       
CONECT    8   35   35   35   25                                       
CONECT    9   10   10   26   47                                       
CONECT   10   28    9    9   48                                       
CONECT   11   24   24    2   49                                       
CONECT   12   25   25   27   50                                       
CONECT   13   15   29   51   52                                       
CONECT   14   29   16   53   54                                       
CONECT   15   13   38   55   56                                       
CONECT   16   38   14   57   58                                       
CONECT   17   41   22   59   60                                       
CONECT   18   30   36   61   62                                       
CONECT   19   26   38   63   64                                       
CONECT   20   24   31   65   66                                       
CONECT   21   39   30   67   68                                       
CONECT   22   36   17   40   40                                       
CONECT   23   27    7   26   26                                       
CONECT   24   20   42   11   11                                       
CONECT   25    8   12   12   39                                       
CONECT   26   23   23    9   19                                       
CONECT   27   12   28   28   23                                       
CONECT   28   39   27   27   10                                       
CONECT   29   13   37   14   69                                       
CONECT   30   21   18   41   70                                       
CONECT   31   20   34   32   33                                       
CONECT   32   31                                                      
CONECT   33   31                                                      
CONECT   34   31                                                      
CONECT   35    8    8    8                                            
CONECT   36   18   22   71                                            
CONECT   37    3   29   72                                            
CONECT   38   15   19   16                                            
CONECT   39   25   21   28                                            
CONECT   40   22   22                                                 
CONECT   41   30   17                                                 
CONECT   42   24    1                                                 
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   19                                                      
CONECT   65   20                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   36                                                      
CONECT   72   37                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
