COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.446  -0.730   0.128  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.419  -1.737  -0.433  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.140  -3.683   1.150  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.339  -6.225  -0.020  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.154   0.797   0.887  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.692   5.289   1.994  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.494   4.469  -0.006  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.005   5.538  -0.733  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.637   5.717  -2.050  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.758   4.834  -2.660  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.241   3.769  -1.957  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.599   3.577  -0.619  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.050   2.440   0.139  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.616   0.547   0.388  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.522  -5.133   0.317  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.167  -5.013  -1.801  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.591  -3.980  -0.484  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.185   0.160  -0.047  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.863   4.287   1.320  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.705  -3.086   0.062  1.00  0.00           N  
HETATM   21  N   UNL     1      -2.620  -4.884   1.298  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.314  -7.386   0.733  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.135  -6.117  -1.078  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.420  -3.965  -1.523  1.00  0.00           N  
HETATM   25  O   UNL     1      -4.444   2.215   1.267  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.112   1.649  -0.417  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.472  -0.473  -0.833  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.143  -1.280   0.065  1.00  0.00           O  
HETATM   29  O   UNL     1       1.162   0.523   0.401  1.00  0.00           O  
HETATM   30  O   UNL     1       2.485   0.594   2.549  1.00  0.00           O  
HETATM   31  O   UNL     1       2.544   2.652   1.088  1.00  0.00           O  
HETATM   32  O   UNL     1       3.790   0.443   0.394  1.00  0.00           O  
HETATM   33  O   UNL     1       5.451  -1.106   1.717  1.00  0.00           O  
HETATM   34  O   UNL     1       5.789   1.393   1.607  1.00  0.00           O  
HETATM   35  O   UNL     1       6.235   0.074  -0.498  1.00  0.00           O  
HETATM   36  O   UNL     1       8.566  -0.997   0.077  1.00  0.00           O  
HETATM   37  O   UNL     1       8.333   1.473  -0.386  1.00  0.00           O  
HETATM   38  P   UNL     1       2.495   1.043   1.139  1.00  0.00           P  
HETATM   39  P   UNL     1       5.326   0.227   0.822  1.00  0.00           P  
HETATM   40  P   UNL     1       7.819   0.142  -0.780  1.00  0.00           P  
HETATM   41  S   UNL     1       8.183  -0.174  -2.844  1.00  0.00           S  
HETATM   42  H   UNL     1      -3.877  -1.101   1.058  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.428  -1.722  -1.523  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.399  -3.229   1.791  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.312   1.875   0.921  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.265   0.382   1.889  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.174   6.248   1.994  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.641   5.389   1.468  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.877   4.976   3.022  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.690   6.229  -0.266  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.036   6.549  -2.610  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.481   4.981  -3.693  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.557   3.085  -2.437  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.636   0.807   1.447  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.829  -4.967  -2.652  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.005   0.468  -1.077  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.572   3.496   1.800  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.727  -7.453   1.503  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.882  -8.134   0.490  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.986  -1.255  -1.078  1.00  0.00           H  
HETATM   61  H   UNL     1       2.552   3.017   0.193  1.00  0.00           H  
HETATM   62  H   UNL     1       5.165  -1.912   1.265  1.00  0.00           H  
HETATM   63  H   UNL     1       8.278  -1.897  -0.129  1.00  0.00           H  
HETATM   64  H   UNL     1       9.523  -0.090  -2.931  1.00  0.00           H  
CONECT    1   27    2   14   42                                       
CONECT    2   20    1   28   43                                       
CONECT    3   21   21   20   44                                       
CONECT    4   22   15   15   23                                       
CONECT    5   29   18   45   46                                       
CONECT    6   19   47   48   49                                       
CONECT    7   12   12    8   19                                       
CONECT    8    9    9    7   50                                       
CONECT    9   10    8    8   51                                       
CONECT   10   11   11    9   52                                       
CONECT   11   10   10   12   53                                       
CONECT   12   11   13    7    7                                       
CONECT   13   12   26   25   25                                       
CONECT   14    1   18   26   54                                       
CONECT   15   21    4    4   17                                       
CONECT   16   23   23   24   55                                       
CONECT   17   15   20   24   24                                       
CONECT   18   28    5   14   56                                       
CONECT   19    7    6   57                                            
CONECT   20    3   17    2                                            
CONECT   21    3    3   15                                            
CONECT   22    4   58   59                                            
CONECT   23    4   16   16                                            
CONECT   24   17   17   16                                            
CONECT   25   13   13                                                 
CONECT   26   14   13                                                 
CONECT   27    1   60                                                 
CONECT   28    2   18                                                 
CONECT   29   38    5                                                 
CONECT   30   38   38                                                 
CONECT   31   38   61                                                 
CONECT   32   39   38                                                 
CONECT   33   39   62                                                 
CONECT   34   39   39                                                 
CONECT   35   40   39                                                 
CONECT   36   40   63                                                 
CONECT   37   40   40                                                 
CONECT   38   30   30   31   32                                       
CONECT   38   29                                                      
CONECT   39   35   34   34   32                                       
CONECT   39   33                                                      
CONECT   40   37   37   35   41                                       
CONECT   40   36                                                      
CONECT   41   40   64                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   14                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   27                                                      
CONECT   61   31                                                      
CONECT   62   33                                                      
CONECT   63   36                                                      
CONECT   64   41                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
