COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.501   1.324  -1.146  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.734   1.711  -0.764  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.858   1.469  -1.618  1.00  0.00           C  
HETATM    4  C   UNL     1       1.376  -1.933   0.124  1.00  0.00           C  
HETATM    5  C   UNL     1       0.533  -2.772   0.837  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.735  -2.340   1.197  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.160  -1.072   0.848  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.321  -0.230   0.136  1.00  0.00           C  
HETATM    9  C   UNL     1       0.952  -0.662  -0.227  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.986   1.400   0.175  1.00  0.00           C  
HETATM   11  C   UNL     1       3.073  -0.343  -1.253  1.00  0.00           C  
HETATM   12  C   UNL     1       3.855   0.721  -2.026  1.00  0.00           C  
HETATM   13  C   UNL     1       5.220   1.915  -0.408  1.00  0.00           C  
HETATM   14  C   UNL     1       4.604   3.990   0.473  1.00  0.00           C  
HETATM   15  C   UNL     1       3.424   3.959  -0.310  1.00  0.00           C  
HETATM   16  C   UNL     1       3.196   2.897  -1.112  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.174   2.028   1.399  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.441   2.426   1.793  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.527   2.199   0.970  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.347   1.567  -0.265  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.067   1.168  -0.659  1.00  0.00           C  
HETATM   22  F   UNL     1      -3.615   3.036   2.985  1.00  0.00           F  
HETATM   23  N   UNL     1       4.103   1.873  -1.156  1.00  0.00           N  
HETATM   24  N   UNL     1       5.473   2.962   0.400  1.00  0.00           N  
HETATM   25  N   UNL     1      -8.749   1.277  -2.296  1.00  0.00           N  
HETATM   26  O   UNL     1       0.948  -4.020   1.181  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.739   1.018  -0.207  1.00  0.00           O  
HETATM   28  O   UNL     1       1.780   0.165  -0.920  1.00  0.00           O  
HETATM   29  O   UNL     1       6.011   0.993  -0.459  1.00  0.00           O  
HETATM   30  O   UNL     1       4.832   4.937   1.203  1.00  0.00           O  
HETATM   31  O   UNL     1       0.684  -4.447  -1.122  1.00  0.00           O  
HETATM   32  O   UNL     1       1.417  -6.221   0.479  1.00  0.00           O  
HETATM   33  S   UNL     1       0.628  -5.088   0.145  1.00  0.00           S  
HETATM   34  H   UNL     1      -5.360   0.832  -2.097  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.875   2.203   0.187  1.00  0.00           H  
HETATM   36  H   UNL     1       2.365  -2.268  -0.153  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.390  -2.995   1.752  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.147  -0.737   1.129  1.00  0.00           H  
HETATM   39  H   UNL     1       2.966  -1.235  -1.871  1.00  0.00           H  
HETATM   40  H   UNL     1       3.611  -0.596  -0.340  1.00  0.00           H  
HETATM   41  H   UNL     1       4.806   0.305  -2.357  1.00  0.00           H  
HETATM   42  H   UNL     1       3.276   1.039  -2.894  1.00  0.00           H  
HETATM   43  H   UNL     1       2.717   4.774  -0.266  1.00  0.00           H  
HETATM   44  H   UNL     1       2.302   2.856  -1.716  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.328   2.207   2.047  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.514   2.509   1.279  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.921   0.679  -1.611  1.00  0.00           H  
HETATM   48  H   UNL     1       6.284   2.976   0.933  1.00  0.00           H  
HETATM   49  F   UNL     1      -0.907  -5.522   0.367  1.00  0.00           F  
CONECT    1   20    2    2   34                                       
CONECT    2    1    1    3   35                                       
CONECT    3    2   25   25   25                                       
CONECT    4    5    9    9   36                                       
CONECT    5   26    6    6    4                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   38                                       
CONECT    8    7    7    9   27                                       
CONECT    9    4    4    8   28                                       
CONECT   10   27   17   17   21                                       
CONECT   11   28   12   39   40                                       
CONECT   12   11   23   41   42                                       
CONECT   13   29   29   24   23                                       
CONECT   14   24   30   30   15                                       
CONECT   15   14   16   16   43                                       
CONECT   16   23   15   15   44                                       
CONECT   17   10   10   18   45                                       
CONECT   18   17   22   19   19                                       
CONECT   19   18   18   20   46                                       
CONECT   20   21   21   19    1                                       
CONECT   21   10   20   20   47                                       
CONECT   22   18                                                      
CONECT   23   13   12   16                                            
CONECT   24   13   14   48                                            
CONECT   25    3    3    3                                            
CONECT   26   33    5                                                 
CONECT   27    8   10                                                 
CONECT   28    9   11                                                 
CONECT   29   13   13                                                 
CONECT   30   14   14                                                 
CONECT   31   33   33                                                 
CONECT   32   33   33                                                 
CONECT   33   32   32   26   31                                       
CONECT   33   31   49                                                 
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   33                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
