COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.745   0.770   0.472  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.759   2.072   0.963  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.865   2.542   1.643  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.965   1.725   1.842  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.971   0.432   1.363  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.864  -0.059   0.668  1.00  0.00           C  
HETATM    7  C   UNL     1       2.971  -0.383   0.507  1.00  0.00           C  
HETATM    8  C   UNL     1       2.237  -1.530   0.231  1.00  0.00           C  
HETATM    9  N   UNL     1       0.863  -1.460   0.000  1.00  0.00           N  
HETATM   10  C   UNL     1       0.145  -0.225   0.341  1.00  0.00           C  
HETATM   11  C   UNL     1       0.980   0.958  -0.167  1.00  0.00           C  
HETATM   12  C   UNL     1       2.317   0.972   0.574  1.00  0.00           C  
HETATM   13  C   UNL     1       4.965  -1.719   0.679  1.00  0.00           C  
HETATM   14  C   UNL     1       4.224  -2.868   0.398  1.00  0.00           C  
HETATM   15  C   UNL     1       2.868  -2.770   0.179  1.00  0.00           C  
HETATM   16  C   UNL     1       4.330  -0.478   0.732  1.00  0.00           C  
HETATM   17  C   UNL     1       6.420  -1.817   0.921  1.00  0.00           C  
HETATM   18  N   UNL     1       7.047  -3.043   0.869  1.00  0.00           N  
HETATM   19  N   UNL     1       7.111  -0.743   1.183  1.00  0.00           N  
HETATM   20  C   UNL     1       3.228   1.997  -0.050  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.206  -0.219  -0.327  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.309   0.255   0.356  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.560   0.262  -0.259  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.694  -0.211  -1.563  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.581  -0.686  -2.241  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.337  -0.683  -1.622  1.00  0.00           C  
HETATM   27  C   UNL     1       3.687   3.063   0.701  1.00  0.00           C  
HETATM   28  C   UNL     1       4.523   4.003   0.129  1.00  0.00           C  
HETATM   29  C   UNL     1       4.901   3.877  -1.195  1.00  0.00           C  
HETATM   30  C   UNL     1       4.443   2.810  -1.946  1.00  0.00           C  
HETATM   31  C   UNL     1       3.611   1.868  -1.372  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.710  -1.162  -3.548  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.864  -1.441   0.153  1.00  0.00           C  
HETATM   34  O   UNL     1      -6.981  -2.191   0.236  1.00  0.00           O  
HETATM   35  O   UNL     1      -4.858  -1.903  -0.346  1.00  0.00           O  
HETATM   36  H   UNL     1      -3.905   2.715   0.812  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.871   3.553   2.023  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.825   2.103   2.376  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.832  -0.200   1.522  1.00  0.00           H  
HETATM   40  H   UNL     1       0.388  -2.216  -0.380  1.00  0.00           H  
HETATM   41  H   UNL     1       0.024  -0.154   1.421  1.00  0.00           H  
HETATM   42  H   UNL     1       1.157   0.848  -1.237  1.00  0.00           H  
HETATM   43  H   UNL     1       0.447   1.890   0.023  1.00  0.00           H  
HETATM   44  H   UNL     1       2.142   1.237   1.617  1.00  0.00           H  
HETATM   45  H   UNL     1       4.711  -3.831   0.357  1.00  0.00           H  
HETATM   46  H   UNL     1       2.292  -3.659  -0.034  1.00  0.00           H  
HETATM   47  H   UNL     1       4.903   0.411   0.949  1.00  0.00           H  
HETATM   48  H   UNL     1       6.532  -3.842   0.673  1.00  0.00           H  
HETATM   49  H   UNL     1       8.066  -0.807   1.342  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.202   0.621   1.366  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.662  -0.213  -2.043  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.471  -1.053  -2.151  1.00  0.00           H  
HETATM   53  H   UNL     1       3.392   3.162   1.735  1.00  0.00           H  
HETATM   54  H   UNL     1       4.881   4.836   0.715  1.00  0.00           H  
HETATM   55  H   UNL     1       5.554   4.611  -1.643  1.00  0.00           H  
HETATM   56  H   UNL     1       4.738   2.712  -2.980  1.00  0.00           H  
HETATM   57  H   UNL     1       3.256   1.033  -1.958  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.578  -1.160  -3.982  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.932  -1.494  -4.023  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.932  -3.091  -0.115  1.00  0.00           H  
HETATM   61  H   UNL     1       8.001  -3.108   1.027  1.00  0.00           H  
CONECT    1    6    6    2   23                                       
CONECT    2    3    3    1   36                                       
CONECT    3    4    2    2   37                                       
CONECT    4    5    5    3   38                                       
CONECT    5    4    4    6   39                                       
CONECT    6   33    5    1    1                                       
CONECT    7    8   12   16   16                                       
CONECT    8    9   15   15    7                                       
CONECT    9   10    8   40                                            
CONECT   10   21    9   11   41                                       
CONECT   11   10   12   42   43                                       
CONECT   12   11    7   20   44                                       
CONECT   13   14   14   16   17                                       
CONECT   14   15   13   13   45                                       
CONECT   15    8    8   14   46                                       
CONECT   16    7    7   13   47                                       
CONECT   17   13   18   19   19                                       
CONECT   18   17   48   61                                            
CONECT   19   17   17   49                                            
CONECT   20   12   27   27   31                                       
CONECT   21   26   26   22   10                                       
CONECT   22   23   23   21   50                                       
CONECT   23   24    1   22   22                                       
CONECT   24   25   25   23   51                                       
CONECT   25   32   24   24   26                                       
CONECT   26   25   21   21   52                                       
CONECT   27   20   20   28   53                                       
CONECT   28   27   29   29   54                                       
CONECT   29   28   28   30   55                                       
CONECT   30   31   31   29   56                                       
CONECT   31   20   30   30   57                                       
CONECT   32   25   58   59                                            
CONECT   33   35   35    6   34                                       
CONECT   34   33   60                                                 
CONECT   35   33   33                                                 
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   34                                                      
CONECT   61   18                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
