COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  N   UNL     1      -5.980  -4.040  -0.232  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.518  -2.775  -0.194  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.324  -2.561  -0.276  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.461  -1.649  -0.051  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.129   0.319  -0.146  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.878  -0.241  -0.167  1.00  0.00           C  
HETATM    7  C   UNL     1       0.254   0.572  -0.068  1.00  0.00           C  
HETATM    8  C   UNL     1       1.602  -0.033  -0.091  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.831  -1.893   0.043  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.723  -0.846   0.177  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.267   0.456   0.218  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.901   0.720   0.125  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.110   1.967   0.144  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.713   1.516   0.016  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.613   2.309  -0.014  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.273   1.707  -0.031  1.00  0.00           C  
HETATM   17  N   UNL     1       2.694   0.751   0.005  1.00  0.00           N  
HETATM   18  O   UNL     1      -6.520   3.109   0.243  1.00  0.00           O  
HETATM   19  O   UNL     1       1.726  -1.238  -0.195  1.00  0.00           O  
HETATM   20  C   UNL     1       4.031   0.151  -0.018  1.00  0.00           C  
HETATM   21  C   UNL     1       5.086   1.252   0.105  1.00  0.00           C  
HETATM   22  C   UNL     1       6.461   0.635   0.082  1.00  0.00           C  
HETATM   23  N   UNL     1       7.455   0.978  -0.781  1.00  0.00           N  
HETATM   24  C   UNL     1       8.549   0.191  -0.482  1.00  0.00           C  
HETATM   25  C   UNL     1       9.831   0.080  -1.002  1.00  0.00           C  
HETATM   26  C   UNL     1      10.711  -0.833  -0.460  1.00  0.00           C  
HETATM   27  C   UNL     1      10.323  -1.640   0.600  1.00  0.00           C  
HETATM   28  C   UNL     1       9.065  -1.545   1.124  1.00  0.00           C  
HETATM   29  C   UNL     1       8.156  -0.627   0.592  1.00  0.00           C  
HETATM   30  N   UNL     1       6.872  -0.300   0.889  1.00  0.00           N  
HETATM   31  C   UNL     1       0.112   1.957   0.053  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.138   2.520   0.068  1.00  0.00           C  
HETATM   33  O   UNL     1      -4.728   0.165  -0.065  1.00  0.00           O  
HETATM   34  C   UNL     1      -5.981  -0.329  -0.005  1.00  0.00           C  
HETATM   35  H   UNL     1      -5.360  -4.780  -0.326  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.932  -4.211  -0.163  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.004  -0.310  -0.222  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.767  -1.311  -0.260  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.198  -2.908   0.011  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.782  -1.048   0.248  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.968   1.271   0.322  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.723   3.384  -0.025  1.00  0.00           H  
HETATM   43  H   UNL     1       2.596   1.712   0.089  1.00  0.00           H  
HETATM   44  H   UNL     1       4.131  -0.544   0.816  1.00  0.00           H  
HETATM   45  H   UNL     1       4.173  -0.385  -0.956  1.00  0.00           H  
HETATM   46  H   UNL     1       4.986   1.946  -0.729  1.00  0.00           H  
HETATM   47  H   UNL     1       4.944   1.788   1.044  1.00  0.00           H  
HETATM   48  H   UNL     1       7.404   1.650  -1.479  1.00  0.00           H  
HETATM   49  H   UNL     1      10.138   0.705  -1.827  1.00  0.00           H  
HETATM   50  H   UNL     1      11.709  -0.921  -0.863  1.00  0.00           H  
HETATM   51  H   UNL     1      11.022  -2.351   1.015  1.00  0.00           H  
HETATM   52  H   UNL     1       8.773  -2.178   1.949  1.00  0.00           H  
HETATM   53  H   UNL     1       0.988   2.584   0.129  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.246   3.591   0.161  1.00  0.00           H  
CONECT    1    2   35   36                                            
CONECT    2    4    1    3    3                                       
CONECT    3    2    2                                                 
CONECT    4   34    9    9    2                                       
CONECT    5   16   16    6   37                                       
CONECT    6    7    7    5   38                                       
CONECT    7   31    8    6    6                                       
CONECT    8   17    7   19   19                                       
CONECT    9    4    4   10   39                                       
CONECT   10   11   11    9   40                                       
CONECT   11   12   10   10   41                                       
CONECT   12   13   34   34   11                                       
CONECT   13   18   18   14   12                                       
CONECT   14   15   15   13   33                                       
CONECT   15   16   14   14   42                                       
CONECT   16   32   15    5    5                                       
CONECT   17   20    8   43                                            
CONECT   18   13   13                                                 
CONECT   19    8    8                                                 
CONECT   20   21   17   44   45                                       
CONECT   21   20   22   46   47                                       
CONECT   22   21   23   30   30                                       
CONECT   23   22   24   48                                            
CONECT   24   23   29   29   25                                       
CONECT   25   24   26   26   49                                       
CONECT   26   25   25   27   50                                       
CONECT   27   28   28   26   51                                       
CONECT   28   29   27   27   52                                       
CONECT   29   30   24   24   28                                       
CONECT   30   22   22   29                                            
CONECT   31   32   32    7   53                                       
CONECT   32   31   31   16   54                                       
CONECT   33   14   34                                                 
CONECT   34   33   12   12    4                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
