COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.939   2.633  -0.361  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.791   1.672   2.775  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.925   1.803   0.194  1.00  0.00           O  
HETATM    4  C   UNL     1       0.041   1.853   1.532  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.575   1.911   0.287  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.455   0.565   0.045  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.844   0.394  -0.056  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.352   0.270  -0.220  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.758  -0.911  -0.295  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.357  -0.897  -0.209  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.184  -1.716  -0.154  1.00  0.00           C  
HETATM   12  C   UNL     1       0.054  -2.602  -0.235  1.00  0.00           C  
HETATM   13  C   UNL     1       0.898  -3.504   0.403  1.00  0.00           C  
HETATM   14  C   UNL     1       2.264  -3.310   0.376  1.00  0.00           C  
HETATM   15  C   UNL     1       1.410   1.967   1.632  1.00  0.00           C  
HETATM   16  C   UNL     1       2.798  -2.204  -0.296  1.00  0.00           C  
HETATM   17  C   UNL     1       4.215  -1.998  -0.328  1.00  0.00           C  
HETATM   18  C   UNL     1       1.943  -1.300  -0.936  1.00  0.00           C  
HETATM   19  C   UNL     1       0.582  -1.501  -0.903  1.00  0.00           C  
HETATM   20  C   UNL     1       2.181   2.136   0.477  1.00  0.00           C  
HETATM   21  C   UNL     1       3.643   2.258   0.578  1.00  0.00           C  
HETATM   22  C   UNL     1       4.386   2.420  -0.538  1.00  0.00           C  
HETATM   23  C   UNL     1       5.809   2.539  -0.439  1.00  0.00           C  
HETATM   24  C   UNL     1       1.557   2.188  -0.775  1.00  0.00           C  
HETATM   25  C   UNL     1       0.188   2.078  -0.863  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.486   2.140  -2.210  1.00  0.00           C  
HETATM   27  F   UNL     1       3.085  -4.186   0.996  1.00  0.00           F  
HETATM   28  N   UNL     1      -3.479  -1.925  -0.252  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.324  -2.804  -0.209  1.00  0.00           N  
HETATM   30  N   UNL     1       5.339  -1.835  -0.354  1.00  0.00           N  
HETATM   31  N   UNL     1      -1.670  -0.501  -0.012  1.00  0.00           N  
HETATM   32  S   UNL     1      -5.166   1.551  -0.027  1.00  0.00           S  
HETATM   33  H   UNL     1      -1.084   2.648   3.162  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.684   1.095   2.533  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.209   1.141   3.528  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.419   0.425  -0.271  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.317  -1.827  -0.415  1.00  0.00           H  
HETATM   38  H   UNL     1       0.485  -4.357   0.921  1.00  0.00           H  
HETATM   39  H   UNL     1       1.886   1.927   2.600  1.00  0.00           H  
HETATM   40  H   UNL     1       2.351  -0.445  -1.455  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.077  -0.803  -1.397  1.00  0.00           H  
HETATM   42  H   UNL     1       4.123   2.217   1.544  1.00  0.00           H  
HETATM   43  H   UNL     1       3.906   2.461  -1.504  1.00  0.00           H  
HETATM   44  H   UNL     1       2.149   2.318  -1.669  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.736   3.174  -2.444  1.00  0.00           H  
HETATM   46  H   UNL     1       0.188   1.747  -2.972  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.397   1.542  -2.188  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.683  -3.705  -0.231  1.00  0.00           H  
CONECT    1   23   23   23                                            
CONECT    2    4   33   34   35                                       
CONECT    3    6    5                                                 
CONECT    4    5    2   15   15                                       
CONECT    5    3   25   25    4                                       
CONECT    6   31    7    7    3                                       
CONECT    7   10    6    6   32                                       
CONECT    8    9    9   32   36                                       
CONECT    9   10    8    8   37                                       
CONECT   10   28   28    9    7                                       
CONECT   11   28   29   31   31                                       
CONECT   12   19   29   13   13                                       
CONECT   13   12   12   14   38                                       
CONECT   14   16   16   13   27                                       
CONECT   15    4    4   20   39                                       
CONECT   16   18   17   14   14                                       
CONECT   17   16   30   30   30                                       
CONECT   18   19   19   16   40                                       
CONECT   19   18   18   12   41                                       
CONECT   20   24   24   15   21                                       
CONECT   21   20   22   22   42                                       
CONECT   22   21   21   23   43                                       
CONECT   23   22    1    1    1                                       
CONECT   24   25   20   20   44                                       
CONECT   25   26    5    5   24                                       
CONECT   26   25   45   46   47                                       
CONECT   27   14                                                      
CONECT   28   10   10   11                                            
CONECT   29   12   11   48                                            
CONECT   30   17   17   17                                            
CONECT   31   11   11    6                                            
CONECT   32    8    7                                                 
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
