COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.789   0.720   4.704  1.00  0.00           N  
HETATM    2  C   UNL     1       4.124  -0.248   4.142  1.00  0.00           C  
HETATM    3  N   UNL     1       4.693  -1.498   4.027  1.00  0.00           N  
HETATM    4  C   UNL     1       2.757  -0.007   3.626  1.00  0.00           C  
HETATM    5  C   UNL     1       2.179   1.256   3.740  1.00  0.00           C  
HETATM    6  C   UNL     1       0.905   1.475   3.258  1.00  0.00           C  
HETATM    7  C   UNL     1       0.201   0.444   2.662  1.00  0.00           C  
HETATM    8  C   UNL     1       0.770  -0.811   2.546  1.00  0.00           C  
HETATM    9  C   UNL     1       2.046  -1.041   3.019  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.189   0.689   2.137  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.984  -0.558   2.184  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.699  -0.512   3.503  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.817   0.538   3.354  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.077   0.639   1.839  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.077  -0.332   1.181  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.381   0.395   0.013  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.778  -0.618  -0.933  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.444  -0.547  -0.869  1.00  0.00           N  
HETATM   19  C   UNL     1       0.032   0.383  -0.011  1.00  0.00           C  
HETATM   20  O   UNL     1       1.205   0.609   0.196  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.139   1.077   0.645  1.00  0.00           C  
HETATM   22  C   UNL     1       0.433  -1.403  -1.670  1.00  0.00           C  
HETATM   23  C   UNL     1       0.733  -0.727  -2.983  1.00  0.00           C  
HETATM   24  C   UNL     1       1.829   0.107  -3.095  1.00  0.00           C  
HETATM   25  C   UNL     1       2.108   0.729  -4.298  1.00  0.00           C  
HETATM   26  C   UNL     1       1.290   0.516  -5.395  1.00  0.00           C  
HETATM   27  O   UNL     1       1.342   0.999  -6.670  1.00  0.00           O  
HETATM   28  C   UNL     1       0.032   0.769  -7.223  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.998   0.108   4.033  1.00  0.00           O  
HETATM   30  O   UNL     1      -0.453  -0.368  -6.488  1.00  0.00           O  
HETATM   31  C   UNL     1       0.185  -0.324  -5.282  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.085  -0.948  -4.075  1.00  0.00           C  
HETATM   33  O   UNL     1      -2.407  -1.375  -1.641  1.00  0.00           O  
HETATM   34  H   UNL     1       4.388   1.600   4.785  1.00  0.00           H  
HETATM   35  H   UNL     1       5.589  -1.656   4.365  1.00  0.00           H  
HETATM   36  H   UNL     1       4.197  -2.220   3.613  1.00  0.00           H  
HETATM   37  H   UNL     1       2.727   2.062   4.206  1.00  0.00           H  
HETATM   38  H   UNL     1       0.456   2.453   3.346  1.00  0.00           H  
HETATM   39  H   UNL     1       0.216  -1.613   2.080  1.00  0.00           H  
HETATM   40  H   UNL     1       2.488  -2.021   2.927  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.679   1.473   2.716  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.010  -0.221   4.296  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.127  -1.492   3.715  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.486   1.500   3.745  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.897   1.656   1.492  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.100   0.338   1.611  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.547  -1.265   0.870  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.039   1.102  -0.491  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.126   2.156   0.493  1.00  0.00           H  
HETATM   50  H   UNL     1       1.364  -1.576  -1.130  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.060  -2.357  -1.857  1.00  0.00           H  
HETATM   52  H   UNL     1       2.469   0.274  -2.241  1.00  0.00           H  
HETATM   53  H   UNL     1       2.965   1.381  -4.382  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.609   1.635  -7.058  1.00  0.00           H  
HETATM   55  H   UNL     1       0.100   0.539  -8.286  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.780   0.063   4.973  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.937  -1.605  -3.987  1.00  0.00           H  
CONECT    1    2    2   34                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   35   36                                            
CONECT    4    2    5    5    9                                       
CONECT    5    4    4    6   37                                       
CONECT    6    5    7    7   38                                       
CONECT    7    6    6    8   10                                       
CONECT    8    7    9    9   39                                       
CONECT    9    4    8    8   40                                       
CONECT   10    7   11   21   41                                       
CONECT   11   10   12   15                                            
CONECT   12   11   13   42   43                                       
CONECT   13   12   14   29   44                                       
CONECT   14   13   15   45   46                                       
CONECT   15   11   14   16   47                                       
CONECT   16   15   17   21   48                                       
CONECT   17   16   18   33   33                                       
CONECT   18   17   19   22                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   10   16   19   49                                       
CONECT   22   18   23   50   51                                       
CONECT   23   22   24   24   32                                       
CONECT   24   23   23   25   52                                       
CONECT   25   24   26   26   53                                       
CONECT   26   25   25   27   31                                       
CONECT   27   26   28                                                 
CONECT   28   27   30   54   55                                       
CONECT   29   13   56                                                 
CONECT   30   28   31                                                 
CONECT   31   26   30   32   32                                       
CONECT   32   23   31   31   57                                       
CONECT   33   17   17                                                 
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   32                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
