COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.258   2.566   0.196  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.890   3.376  -0.130  1.00  0.00           C  
HETATM    3  C   UNL     1       0.089  -2.045   0.386  1.00  0.00           C  
HETATM    4  C   UNL     1       3.619   0.762  -0.140  1.00  0.00           C  
HETATM    5  C   UNL     1       4.474   2.720   0.941  1.00  0.00           C  
HETATM    6  C   UNL     1       2.865   2.931  -0.820  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.737  -3.143  -0.278  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.639  -2.125  -0.108  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.330  -2.543   0.055  1.00  0.00           C  
HETATM   10  F   UNL     1      -2.039  -3.862   0.059  1.00  0.00           F  
HETATM   11  C   UNL     1      -1.309  -1.600   0.213  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.615  -0.240   0.208  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.933   0.170   0.045  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.943  -0.779  -0.119  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.266   1.616   0.038  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.573   3.910   0.190  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.885   4.314   0.027  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.586   2.030  -0.125  1.00  0.00           C  
HETATM   19  O   UNL     1       0.354  -3.231   0.391  1.00  0.00           O  
HETATM   20  N   UNL     1       1.071  -1.134   0.539  1.00  0.00           N  
HETATM   21  N   UNL     1       2.398  -1.556   0.703  1.00  0.00           N  
HETATM   22  S   UNL     1       3.578  -0.991  -0.312  1.00  0.00           S  
HETATM   23  O   UNL     1       3.128  -1.254  -1.635  1.00  0.00           O  
HETATM   24  O   UNL     1       4.812  -1.474   0.200  1.00  0.00           O  
HETATM   25  C   UNL     1       4.441   1.344   0.806  1.00  0.00           C  
HETATM   26  C   UNL     1       3.684   3.513   0.130  1.00  0.00           C  
HETATM   27  C   UNL     1       2.833   1.555  -0.955  1.00  0.00           C  
HETATM   28  H   UNL     1      -1.234   2.251   0.327  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.913   3.697  -0.256  1.00  0.00           H  
HETATM   30  H   UNL     1       5.116   3.175   1.681  1.00  0.00           H  
HETATM   31  H   UNL     1       2.248   3.550  -1.454  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.136  -3.415   0.699  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.533  -2.720  -0.891  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.336  -4.031  -0.767  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.831   0.492   0.331  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.966  -0.459  -0.250  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.793   4.647   0.312  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.127   5.367   0.023  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.371   1.298  -0.247  1.00  0.00           H  
HETATM   40  H   UNL     1       0.860  -0.188   0.535  1.00  0.00           H  
HETATM   41  H   UNL     1       2.624  -2.178   1.412  1.00  0.00           H  
HETATM   42  H   UNL     1       5.058   0.725   1.440  1.00  0.00           H  
HETATM   43  H   UNL     1       3.709   4.587   0.236  1.00  0.00           H  
HETATM   44  H   UNL     1       2.194   1.100  -1.697  1.00  0.00           H  
CONECT    1   15   15   16   28                                       
CONECT    2   17   18   18   29                                       
CONECT    3   11   19   19   20                                       
CONECT    4   22   25   25   27                                       
CONECT    5   25   26   26   30                                       
CONECT    6   26   27   27   31                                       
CONECT    7    8   32   33   34                                       
CONECT    8    7    9    9   14                                       
CONECT    9    8    8   10   11                                       
CONECT   10    9                                                      
CONECT   11    3    9   12   12                                       
CONECT   12   11   11   13   35                                       
CONECT   13   12   14   14   15                                       
CONECT   14    8   13   13   36                                       
CONECT   15    1    1   13   18                                       
CONECT   16    1   17   17   37                                       
CONECT   17    2   16   16   38                                       
CONECT   18    2    2   15   39                                       
CONECT   19    3    3                                                 
CONECT   20    3   21   40                                            
CONECT   21   20   22   41                                            
CONECT   22    4   21   23   23                                       
CONECT   22   24   24                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25    4    4    5   42                                       
CONECT   26    5    5    6   43                                       
CONECT   27    4    6    6   44                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
