COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.739   1.996  -0.105  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.030   2.596   0.026  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.013   1.903  -0.918  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.224   0.546  -0.495  1.00  0.00           O  
HETATM    5  C   UNL     1      -4.378   2.618  -0.871  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.726   3.117  -2.164  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.370   1.515  -0.430  1.00  0.00           C  
HETATM    8  O   UNL     1      -6.593   1.607  -1.162  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.597   0.218  -0.799  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.054  -0.906   0.022  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.484  -1.344   1.180  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.147  -2.363   1.645  1.00  0.00           N  
HETATM   13  C   UNL     1      -6.182  -2.643   0.817  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.138  -1.708  -0.232  1.00  0.00           C  
HETATM   15  N   UNL     1      -7.058  -1.768  -1.189  1.00  0.00           N  
HETATM   16  C   UNL     1      -7.998  -2.689  -1.160  1.00  0.00           C  
HETATM   17  N   UNL     1      -8.080  -3.588  -0.196  1.00  0.00           N  
HETATM   18  C   UNL     1      -7.210  -3.601   0.809  1.00  0.00           C  
HETATM   19  N   UNL     1      -7.303  -4.547   1.814  1.00  0.00           N  
HETATM   20  O   UNL     1       9.744  -4.227  -0.550  1.00  0.00           O  
HETATM   21  C   UNL     1       9.393  -2.887  -0.201  1.00  0.00           C  
HETATM   22  C   UNL     1       7.908  -2.657  -0.491  1.00  0.00           C  
HETATM   23  O   UNL     1       7.676  -2.754  -1.897  1.00  0.00           O  
HETATM   24  C   UNL     1       7.503  -1.265  -0.002  1.00  0.00           C  
HETATM   25  O   UNL     1       7.735  -1.167   1.405  1.00  0.00           O  
HETATM   26  C   UNL     1       6.018  -1.035  -0.291  1.00  0.00           C  
HETATM   27  O   UNL     1       5.786  -1.132  -1.698  1.00  0.00           O  
HETATM   28  C   UNL     1       5.613   0.357   0.197  1.00  0.00           C  
HETATM   29  O   UNL     1       4.203   0.528   0.033  1.00  0.00           O  
HETATM   30  P   UNL     1       3.430   1.879   0.445  1.00  0.00           P  
HETATM   31  O   UNL     1       3.934   3.091  -0.487  1.00  0.00           O  
HETATM   32  O   UNL     1       3.712   2.197   1.862  1.00  0.00           O  
HETATM   33  O   UNL     1       1.846   1.672   0.246  1.00  0.00           O  
HETATM   34  P   UNL     1       0.542   2.476   0.742  1.00  0.00           P  
HETATM   35  O   UNL     1       0.751   3.927   0.540  1.00  0.00           O  
HETATM   36  O   UNL     1       0.293   2.182   2.305  1.00  0.00           O  
HETATM   37  H   UNL     1      -2.376   2.490   1.054  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.965   3.654  -0.228  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.623   1.918  -1.936  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.358   3.429  -0.142  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.577   3.577  -2.191  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.556   1.565   0.643  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.067   2.440  -1.033  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.711  -0.008  -1.859  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.611  -0.909   1.643  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.731  -2.710  -1.953  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.010  -5.211   1.791  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.662  -4.547   2.542  1.00  0.00           H  
HETATM   49  H   UNL     1      10.673  -4.444  -0.393  1.00  0.00           H  
HETATM   50  H   UNL     1       9.585  -2.725   0.859  1.00  0.00           H  
HETATM   51  H   UNL     1       9.990  -2.190  -0.789  1.00  0.00           H  
HETATM   52  H   UNL     1       7.316  -3.411   0.029  1.00  0.00           H  
HETATM   53  H   UNL     1       8.172  -2.112  -2.423  1.00  0.00           H  
HETATM   54  H   UNL     1       8.095  -0.511  -0.521  1.00  0.00           H  
HETATM   55  H   UNL     1       7.239  -1.809   1.930  1.00  0.00           H  
HETATM   56  H   UNL     1       5.426  -1.788   0.228  1.00  0.00           H  
HETATM   57  H   UNL     1       6.282  -0.490  -2.224  1.00  0.00           H  
HETATM   58  H   UNL     1       5.872   0.462   1.250  1.00  0.00           H  
HETATM   59  H   UNL     1       6.140   1.114  -0.384  1.00  0.00           H  
HETATM   60  H   UNL     1       3.781   2.951  -1.432  1.00  0.00           H  
HETATM   61  H   UNL     1       0.148   1.248   2.512  1.00  0.00           H  
CONECT    1    2   34                                                 
CONECT    2    3    1   37   38                                       
CONECT    3    4    5    2   39                                       
CONECT    4    9    3                                                 
CONECT    5    7    6    3   40                                       
CONECT    6    5   41                                                 
CONECT    7    8    9    5   42                                       
CONECT    8    7   43                                                 
CONECT    9   10    7    4   44                                       
CONECT   10   14   11    9                                            
CONECT   11   12   12   10   45                                       
CONECT   12   13   11   11                                            
CONECT   13   18   18   14   12                                       
CONECT   14   15   15   13   10                                       
CONECT   15   16   14   14                                            
CONECT   16   17   17   15   46                                       
CONECT   17   16   16   18                                            
CONECT   18   17   19   13   13                                       
CONECT   19   18   47   48                                            
CONECT   20   21   49                                                 
CONECT   21   22   20   50   51                                       
CONECT   22   23   21   24   52                                       
CONECT   23   22   53                                                 
CONECT   24   22   26   54   25                                       
CONECT   25   55   24                                                 
CONECT   26   27   24   28   56                                       
CONECT   27   26   57                                                 
CONECT   28   26   29   58   59                                       
CONECT   29   30   28                                                 
CONECT   30   33   32   32   29                                       
CONECT   30   31                                                      
CONECT   31   30   60                                                 
CONECT   32   30   30                                                 
CONECT   33   34   30                                                 
CONECT   34    1   35   35   36                                       
CONECT   34   33                                                      
CONECT   35   34   34                                                 
CONECT   36   34   61                                                 
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   31                                                      
CONECT   61   36                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
