COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.438  -0.885   3.672  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.806  -0.455  -0.751  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.027  -0.954  -0.331  1.00  0.00           C  
HETATM    4  C   UNL     1       4.046  -2.198   0.415  1.00  0.00           C  
HETATM    5  C   UNL     1       4.717  -0.977   2.352  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.012   1.406  -0.866  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.328   0.186  -0.279  1.00  0.00           C  
HETATM    8  C   UNL     1       3.434   0.004   0.707  1.00  0.00           C  
HETATM    9  C   UNL     1       0.276   0.744  -0.863  1.00  0.00           C  
HETATM   10  O   UNL     1       2.032   2.370  -1.763  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.690   1.691  -1.164  1.00  0.00           C  
HETATM   12  C   UNL     1       3.403  -4.658  -2.247  1.00  0.00           C  
HETATM   13  C   UNL     1       2.776   2.362   1.015  1.00  0.00           C  
HETATM   14  C   UNL     1       4.078   3.123   0.757  1.00  0.00           C  
HETATM   15  C   UNL     1       5.244   4.371  -0.924  1.00  0.00           C  
HETATM   16  C   UNL     1       3.310  -3.295  -1.558  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.106  -0.449  -0.267  1.00  0.00           C  
HETATM   18  C   UNL     1       0.368  -2.629   0.549  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.707   0.858  -0.286  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.042   0.296   0.132  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.537   0.516   1.410  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.768  -0.016   1.757  1.00  0.00           C  
HETATM   23  C   UNL     1       4.726  -2.157   1.631  1.00  0.00           C  
HETATM   24  F   UNL     1      -6.360  -0.699  -2.003  1.00  0.00           F  
HETATM   25  F   UNL     1      -5.829   1.241   2.303  1.00  0.00           F  
HETATM   26  N   UNL     1       2.772   1.122   0.234  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.379  -0.695   0.000  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.652  -0.111   0.019  1.00  0.00           N  
HETATM   29  N   UNL     1      -8.465  -0.724   0.891  1.00  0.00           N  
HETATM   30  N   UNL     1       4.068   0.072   1.869  1.00  0.00           N  
HETATM   31  N   UNL     1       3.420  -1.108  -0.012  1.00  0.00           N  
HETATM   32  O   UNL     1       4.117   3.551  -0.605  1.00  0.00           O  
HETATM   33  O   UNL     1       2.463  -0.088  -1.894  1.00  0.00           O  
HETATM   34  O   UNL     1       0.834  -1.382   0.030  1.00  0.00           O  
HETATM   35  O   UNL     1       4.029  -3.334  -0.324  1.00  0.00           O  
HETATM   36  S   UNL     1       1.973   1.060  -1.216  1.00  0.00           S  
HETATM   37  H   UNL     1       6.464  -0.559   3.504  1.00  0.00           H  
HETATM   38  H   UNL     1       4.929  -0.167   4.314  1.00  0.00           H  
HETATM   39  H   UNL     1       5.442  -1.863   4.153  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.627  -1.538  -1.012  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.789   2.122  -1.091  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.418   2.631  -1.621  1.00  0.00           H  
HETATM   43  H   UNL     1       2.972  -5.422  -1.599  1.00  0.00           H  
HETATM   44  H   UNL     1       2.854  -4.628  -3.188  1.00  0.00           H  
HETATM   45  H   UNL     1       4.449  -4.895  -2.443  1.00  0.00           H  
HETATM   46  H   UNL     1       2.698   2.123   2.076  1.00  0.00           H  
HETATM   47  H   UNL     1       1.929   2.981   0.719  1.00  0.00           H  
HETATM   48  H   UNL     1       4.127   3.992   1.413  1.00  0.00           H  
HETATM   49  H   UNL     1       4.927   2.468   0.957  1.00  0.00           H  
HETATM   50  H   UNL     1       5.277   5.223  -0.246  1.00  0.00           H  
HETATM   51  H   UNL     1       6.159   3.787  -0.820  1.00  0.00           H  
HETATM   52  H   UNL     1       5.155   4.727  -1.951  1.00  0.00           H  
HETATM   53  H   UNL     1       3.741  -2.531  -2.205  1.00  0.00           H  
HETATM   54  H   UNL     1       2.264  -3.057  -1.362  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.220  -3.142  -0.212  1.00  0.00           H  
HETATM   56  H   UNL     1       1.222  -3.248   0.826  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.251  -2.449   1.427  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.718   1.059  -1.357  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.518   1.784   0.256  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.160   0.151   2.749  1.00  0.00           H  
HETATM   61  H   UNL     1       5.248  -3.026   2.002  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.878  -0.961   0.429  1.00  0.00           H  
CONECT    1    5   37   38   39                                       
CONECT    2   20   24    3    3                                       
CONECT    3    2    2   29   40                                       
CONECT    4   31   35   23   23                                       
CONECT    5   30   30   23    1                                       
CONECT    6   11   11    7   41                                       
CONECT    7   27   27    6   28                                       
CONECT    8   26   31   31   30                                       
CONECT    9   36   17   17   11                                       
CONECT   10   36   36                                                 
CONECT   11    9    6    6   42                                       
CONECT   12   16   43   44   45                                       
CONECT   13   14   26   46   47                                       
CONECT   14   32   13   48   49                                       
CONECT   15   32   50   51   52                                       
CONECT   16   35   12   53   54                                       
CONECT   17   34    9    9   27                                       
CONECT   18   34   55   56   57                                       
CONECT   19   28   20   58   59                                       
CONECT   20   19   21   21    2                                       
CONECT   21   25   20   20   22                                       
CONECT   22   21   29   29   60                                       
CONECT   23    4    4    5   61                                       
CONECT   24    2                                                      
CONECT   25   21                                                      
CONECT   26   36   13    8                                            
CONECT   27   17    7    7                                            
CONECT   28    7   19   62                                            
CONECT   29   22   22    3                                            
CONECT   30    8    5    5                                            
CONECT   31    8    8    4                                            
CONECT   32   15   14                                                 
CONECT   33   36   36                                                 
CONECT   34   18   17                                                 
CONECT   35    4   16                                                 
CONECT   36   33   33   10   10                                       
CONECT   36   26    9                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    6                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   28                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
