COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.153  -1.098   0.147  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.775   0.610  -0.945  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.356   0.348  -1.458  1.00  0.00           C  
HETATM    4  O   UNL     1      -8.371  -1.856   1.071  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.041   0.238  -0.774  1.00  0.00           O  
HETATM    6  O   UNL     1       7.253  -1.105   2.514  1.00  0.00           O  
HETATM    7  C   UNL     1       0.306   1.254   0.228  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.723   0.707  -0.513  1.00  0.00           C  
HETATM    9  C   UNL     1       1.723   1.174  -0.277  1.00  0.00           C  
HETATM   10  C   UNL     1       2.111   2.507  -0.920  1.00  0.00           C  
HETATM   11  C   UNL     1       3.451   2.392  -1.519  1.00  0.00           C  
HETATM   12  C   UNL     1       3.850   0.270   0.610  1.00  0.00           C  
HETATM   13  C   UNL     1       6.981  -1.137   1.337  1.00  0.00           C  
HETATM   14  C   UNL     1       7.935  -1.736   0.322  1.00  0.00           C  
HETATM   15  C   UNL     1       7.477  -1.717  -1.122  1.00  0.00           C  
HETATM   16  C   UNL     1       8.345  -2.286  -2.215  1.00  0.00           C  
HETATM   17  C   UNL     1       5.501  -0.673  -0.452  1.00  0.00           C  
HETATM   18  N   UNL     1       6.325  -1.202  -1.396  1.00  0.00           N  
HETATM   19  N   UNL     1       5.815  -0.641   0.873  1.00  0.00           N  
HETATM   20  N   UNL     1       4.735  -0.031   1.531  1.00  0.00           N  
HETATM   21  N   UNL     1       4.305  -0.117  -0.583  1.00  0.00           N  
HETATM   22  N   UNL     1       2.625   0.891   0.843  1.00  0.00           N  
HETATM   23  N   UNL     1       4.485   2.303  -1.981  1.00  0.00           N  
HETATM   24  C   UNL     1       0.035   1.880   1.431  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.264   1.955   1.897  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.296   1.404   1.162  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.028   0.780  -0.048  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.370   0.450  -0.292  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.707  -0.610   0.758  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.119  -0.359   1.297  1.00  0.00           C  
HETATM   31  N   UNL     1      -7.058  -0.311   0.164  1.00  0.00           N  
HETATM   32  O   UNL     1      -9.000  -1.048  -0.898  1.00  0.00           O  
HETATM   33  C   UNL     1     -10.155  -1.928  -0.853  1.00  0.00           C  
HETATM   34  H   UNL     1      -6.853   1.639  -0.593  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.492   0.444  -1.749  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.305  -0.651  -1.891  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.101   1.087  -2.217  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.511   0.222  -1.455  1.00  0.00           H  
HETATM   39  H   UNL     1       1.801   0.378  -1.016  1.00  0.00           H  
HETATM   40  H   UNL     1       1.388   2.761  -1.694  1.00  0.00           H  
HETATM   41  H   UNL     1       2.119   3.289  -0.160  1.00  0.00           H  
HETATM   42  H   UNL     1       8.880  -1.196   0.385  1.00  0.00           H  
HETATM   43  H   UNL     1       8.123  -2.772   0.603  1.00  0.00           H  
HETATM   44  H   UNL     1       8.114  -3.343  -2.350  1.00  0.00           H  
HETATM   45  H   UNL     1       8.156  -1.751  -3.145  1.00  0.00           H  
HETATM   46  H   UNL     1       9.394  -2.176  -1.939  1.00  0.00           H  
HETATM   47  H   UNL     1       2.369   1.137   1.746  1.00  0.00           H  
HETATM   48  H   UNL     1       0.840   2.311   2.008  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.473   2.444   2.837  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.311   1.462   1.526  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.439   1.441   0.156  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.662  -1.600   0.304  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.990  -0.552   1.577  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.402  -1.167   1.972  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.142   0.591   1.831  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.820  -2.964  -0.796  1.00  0.00           H  
HETATM   57  H   UNL     1     -10.757  -1.692   0.025  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.754  -1.788  -1.753  1.00  0.00           H  
CONECT    1   32    4    4   31                                       
CONECT    2    3   31   34   35                                       
CONECT    3   28    2   36   37                                       
CONECT    4    1    1                                                 
CONECT    5   28   27                                                 
CONECT    6   13   13                                                 
CONECT    7    8    8   24    9                                       
CONECT    8   27    7    7   38                                       
CONECT    9    7   22   10   39                                       
CONECT   10    9   11   40   41                                       
CONECT   11   10   23   23   23                                       
CONECT   12   20   20   21   22                                       
CONECT   13   14    6    6   19                                       
CONECT   14   13   15   42   43                                       
CONECT   15   14   16   18   18                                       
CONECT   16   15   44   45   46                                       
CONECT   17   19   18   21   21                                       
CONECT   18   15   15   17                                            
CONECT   19   13   17   20                                            
CONECT   20   19   12   12                                            
CONECT   21   17   17   12                                            
CONECT   22   12    9   47                                            
CONECT   23   11   11   11                                            
CONECT   24   25   25    7   48                                       
CONECT   25   26   24   24   49                                       
CONECT   26   27   27   25   50                                       
CONECT   27    5   26   26    8                                       
CONECT   28   29    3    5   51                                       
CONECT   29   28   30   52   53                                       
CONECT   30   29   31   54   55                                       
CONECT   31    1   30    2                                            
CONECT   32   33    1                                                 
CONECT   33   32   56   57   58                                       
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   33                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
