COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.643  -0.148   0.377  1.00  0.00           N  
HETATM    2  N   UNL     1      -4.623  -1.509   0.091  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.772   1.466  -0.413  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.890   0.199   1.566  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.465   0.706   1.350  1.00  0.00           C  
HETATM    6  C   UNL     1       0.346  -0.368   0.672  1.00  0.00           C  
HETATM    7  C   UNL     1       2.417  -1.173  -0.173  1.00  0.00           C  
HETATM    8  C   UNL     1       3.857  -3.232  -1.315  1.00  0.00           C  
HETATM    9  C   UNL     1       6.472  -1.635   0.734  1.00  0.00           C  
HETATM   10  C   UNL     1       4.426  -0.419   1.035  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.460   1.945   0.494  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.443  -1.234   1.078  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.972  -1.164  -0.382  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.276  -2.270   0.144  1.00  0.00           O  
HETATM   15  S   UNL     1      -3.073  -1.241  -0.426  1.00  0.00           S  
HETATM   16  O   UNL     1      -3.152  -1.006  -1.826  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.256  -2.191   1.231  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.565   0.179   0.258  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.514   2.293  -0.322  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.438   3.444  -1.095  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.317   4.247  -1.049  1.00  0.00           C  
HETATM   22  C   UNL     1       0.666   2.757   0.542  1.00  0.00           C  
HETATM   23  C   UNL     1       0.739   3.903  -0.225  1.00  0.00           C  
HETATM   24 CL   UNL     1       2.152   4.909  -0.155  1.00  0.00          Cl  
HETATM   25  O   UNL     1      -0.168  -1.430   0.392  1.00  0.00           O  
HETATM   26  C   UNL     1       3.785  -1.300   0.154  1.00  0.00           C  
HETATM   27  C   UNL     1       5.749  -0.593   1.312  1.00  0.00           C  
HETATM   28  C   UNL     1       5.881  -2.509  -0.126  1.00  0.00           C  
HETATM   29  C   UNL     1       4.519  -2.361  -0.436  1.00  0.00           C  
HETATM   30  N   UNL     1       2.582  -3.064  -1.575  1.00  0.00           N  
HETATM   31  C   UNL     1       1.862  -2.087  -1.044  1.00  0.00           C  
HETATM   32  H   UNL     1       2.037   0.722   0.542  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.017   1.294  -1.461  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.592   1.999   0.069  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.864  -0.807   1.984  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.420   0.867   2.245  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.016   0.937   2.316  1.00  0.00           H  
HETATM   38  H   UNL     1       4.398  -4.046  -1.775  1.00  0.00           H  
HETATM   39  H   UNL     1       7.520  -1.750   0.971  1.00  0.00           H  
HETATM   40  H   UNL     1       3.877   0.392   1.489  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.333  -0.299   1.628  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.419  -1.699   1.211  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.039  -0.165  -0.812  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.417  -1.929  -1.018  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.508  -3.231   1.024  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.715  -2.065   2.169  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.263   3.712  -1.739  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.264   5.140  -1.655  1.00  0.00           H  
HETATM   49  H   UNL     1       1.491   2.490   1.185  1.00  0.00           H  
HETATM   50  H   UNL     1       6.244   0.085   1.991  1.00  0.00           H  
HETATM   51  H   UNL     1       6.454  -3.311  -0.566  1.00  0.00           H  
HETATM   52  H   UNL     1       0.816  -2.004  -1.299  1.00  0.00           H  
CONECT    1    7    6   32                                            
CONECT    2   17   13   15                                            
CONECT    3   18   19   33   34                                       
CONECT    4    5   18   35   36                                       
CONECT    5    6    4   11   37                                       
CONECT    6    1    5   25   25                                       
CONECT    7   26   26   31    1                                       
CONECT    8   29   29   30   38                                       
CONECT    9   28   28   27   39                                       
CONECT   10   27   27   26   40                                       
CONECT   11    5   22   22   19                                       
CONECT   12   17   13   41   42                                       
CONECT   13   12    2   43   44                                       
CONECT   14   15   15                                                 
CONECT   15   16   16    2   18                                       
CONECT   15   14   14                                                 
CONECT   16   15   15                                                 
CONECT   17   12    2   45   46                                       
CONECT   18    4   15    3                                            
CONECT   19   11    3   20   20                                       
CONECT   20   19   19   21   47                                       
CONECT   21   23   23   20   48                                       
CONECT   22   11   11   23   49                                       
CONECT   23   22   24   21   21                                       
CONECT   24   23                                                      
CONECT   25    6    6                                                 
CONECT   26   29   10    7    7                                       
CONECT   27    9   10   10   50                                       
CONECT   28    9    9   29   51                                       
CONECT   29   28    8    8   26                                       
CONECT   30    8   31   31                                            
CONECT   31   30   30    7   52                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
