COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.078   2.720   2.597  1.00  0.00           N  
HETATM    2  C   UNL     1       3.015  -1.820   0.236  1.00  0.00           C  
HETATM    3  C   UNL     1       2.917  -0.447   0.011  1.00  0.00           C  
HETATM    4  C   UNL     1       1.668   0.171   0.032  1.00  0.00           C  
HETATM    5  C   UNL     1       0.535  -0.577   0.275  1.00  0.00           C  
HETATM    6  C   UNL     1       1.873  -2.562   0.473  1.00  0.00           C  
HETATM    7  C   UNL     1       0.636  -1.941   0.498  1.00  0.00           C  
HETATM    8  C   UNL     1       4.139   0.354  -0.249  1.00  0.00           C  
HETATM    9  C   UNL     1       4.207   1.227  -1.338  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.145   1.686   1.556  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.858   0.968  -1.154  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.921  -0.156  -0.793  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.508  -0.115  -0.796  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.144  -1.358  -0.401  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.280  -2.039  -0.193  1.00  0.00           O  
HETATM   16  N   UNL     1      -5.253  -1.355  -0.410  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.738  -1.874  -0.229  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.614   1.043  -1.157  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.148   0.599  -1.103  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.816   0.091   0.297  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.792   1.194   1.260  1.00  0.00           N  
HETATM   22  S   UNL     1      -2.852   2.394   0.038  1.00  0.00           S  
HETATM   23  F   UNL     1      -0.479  -2.670   0.729  1.00  0.00           F  
HETATM   24  F   UNL     1       4.223  -2.425   0.218  1.00  0.00           F  
HETATM   25  N   UNL     1       5.315   1.922  -1.533  1.00  0.00           N  
HETATM   26  C   UNL     1       6.344   1.799  -0.719  1.00  0.00           C  
HETATM   27  N   UNL     1       6.322   0.986   0.319  1.00  0.00           N  
HETATM   28  C   UNL     1       5.251   0.260   0.591  1.00  0.00           C  
HETATM   29  H   UNL     1      -2.997   3.072   2.816  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.617   2.370   3.424  1.00  0.00           H  
HETATM   31  H   UNL     1       1.588   1.234  -0.142  1.00  0.00           H  
HETATM   32  H   UNL     1       1.946  -3.626   0.643  1.00  0.00           H  
HETATM   33  H   UNL     1       3.368   1.333  -2.009  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.767   0.860   1.901  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.114   0.902  -2.211  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.766   0.892  -0.555  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.372   1.924  -0.957  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.439  -1.773   0.814  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.699  -2.925  -0.517  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.060  -1.299  -0.859  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.857   1.395  -2.160  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.985  -0.199  -1.827  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.504   1.444  -1.345  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.569  -0.635   0.604  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.312   0.925   2.106  1.00  0.00           H  
HETATM   46  H   UNL     1       7.233   2.382  -0.908  1.00  0.00           H  
HETATM   47  H   UNL     1       5.239  -0.400   1.446  1.00  0.00           H  
CONECT    1   10   29   30                                            
CONECT    2    6   24    3    3                                       
CONECT    3    2    2    4    8                                       
CONECT    4    5    5    3   31                                       
CONECT    5    7   20    4    4                                       
CONECT    6    7    7    2   32                                       
CONECT    7   23    6    6    5                                       
CONECT    8    3    9    9   28                                       
CONECT    9    8    8   25   33                                       
CONECT   10   22   21    1   34                                       
CONECT   11   12   35   36   37                                       
CONECT   12   16   16   11   13                                       
CONECT   13   12   14   14   18                                       
CONECT   14   15   17   13   13                                       
CONECT   15   16   14                                                 
CONECT   16   15   12   12                                            
CONECT   17   14   38   39   40                                       
CONECT   18   13   19   22   41                                       
CONECT   19   18   20   42   43                                       
CONECT   20   19    5   21   44                                       
CONECT   21   20   10   45                                            
CONECT   22   18   10                                                 
CONECT   23    7                                                      
CONECT   24    2                                                      
CONECT   25    9   26   26                                            
CONECT   26   25   25   27   46                                       
CONECT   27   28   28   26                                            
CONECT   28    8   27   27   47                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   26                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
