COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.050  -1.259   2.705  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.465  -0.372   1.529  1.00  0.00           C  
HETATM    3  N   UNL     1      -7.980  -0.963   0.275  1.00  0.00           N  
HETATM    4  C   UNL     1      -8.744  -2.169  -0.069  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.985  -2.969  -1.130  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.022   0.017  -0.819  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.023   1.140  -0.536  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.674   0.604  -0.552  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.668   1.471  -0.319  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.912   2.642  -0.108  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.272   0.997  -0.320  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.989  -0.350  -0.568  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.689  -0.786  -0.574  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.228   1.895  -0.078  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.930   1.451  -0.080  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.652   0.111  -0.332  1.00  0.00           C  
HETATM   17  N   UNL     1       0.665  -0.335  -0.338  1.00  0.00           N  
HETATM   18  C   UNL     1       1.758   0.607  -0.083  1.00  0.00           C  
HETATM   19  C   UNL     1       3.095  -0.135  -0.146  1.00  0.00           C  
HETATM   20  C   UNL     1       4.219   0.834   0.115  1.00  0.00           C  
HETATM   21  O   UNL     1       3.976   2.002   0.331  1.00  0.00           O  
HETATM   22  C   UNL     1       5.613   0.362   0.109  1.00  0.00           C  
HETATM   23  C   UNL     1       5.899  -0.983  -0.144  1.00  0.00           C  
HETATM   24  C   UNL     1       7.208  -1.417  -0.148  1.00  0.00           C  
HETATM   25  C   UNL     1       8.237  -0.526   0.099  1.00  0.00           C  
HETATM   26  N   UNL     1       9.639  -1.000   0.093  1.00  0.00           N1+
HETATM   27  O   UNL     1       9.884  -2.173  -0.128  1.00  0.00           O1-
HETATM   28  O   UNL     1      10.548  -0.219   0.310  1.00  0.00           O  
HETATM   29  C   UNL     1       7.963   0.807   0.350  1.00  0.00           C  
HETATM   30  C   UNL     1       6.660   1.258   0.352  1.00  0.00           C  
HETATM   31  H   UNL     1      -8.328  -0.775   3.641  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.556  -2.222   2.630  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.971  -1.413   2.681  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.551  -0.294   1.498  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.033   0.621   1.654  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.876  -2.782   0.823  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.720  -1.882  -0.460  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.935  -2.391  -2.053  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.976  -3.176  -0.775  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.505  -3.908  -1.317  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.760  -0.474  -1.757  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.026   0.434  -0.895  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.117   1.911  -1.301  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.230   1.573   0.443  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.794  -1.046  -0.755  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.470  -1.826  -0.766  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.443   2.937   0.110  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.123   2.144   0.107  1.00  0.00           H  
HETATM   49  H   UNL     1       0.860  -1.269  -0.510  1.00  0.00           H  
HETATM   50  H   UNL     1       1.743   1.393  -0.838  1.00  0.00           H  
HETATM   51  H   UNL     1       1.634   1.049   0.905  1.00  0.00           H  
HETATM   52  H   UNL     1       3.110  -0.921   0.608  1.00  0.00           H  
HETATM   53  H   UNL     1       3.219  -0.577  -1.135  1.00  0.00           H  
HETATM   54  H   UNL     1       5.097  -1.680  -0.336  1.00  0.00           H  
HETATM   55  H   UNL     1       7.430  -2.456  -0.344  1.00  0.00           H  
HETATM   56  H   UNL     1       8.771   1.497   0.542  1.00  0.00           H  
HETATM   57  H   UNL     1       6.447   2.299   0.544  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    6    4                                            
CONECT    4    3    5   36   37                                       
CONECT    5    4   38   39   40                                       
CONECT    6    7    3   41   42                                       
CONECT    7    8    6   43   44                                       
CONECT    8    7    9                                                 
CONECT    9   11    8   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   12   12   14    9                                       
CONECT   12   13   11   11   45                                       
CONECT   13   16   16   12   46                                       
CONECT   14   15   15   11   47                                       
CONECT   15   16   14   14   48                                       
CONECT   16   17   13   13   15                                       
CONECT   17   18   16   49                                            
CONECT   18   19   17   50   51                                       
CONECT   19   20   18   52   53                                       
CONECT   20   21   21   22   19                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   23   30                                       
CONECT   23   22   22   24   54                                       
CONECT   24   23   25   25   55                                       
CONECT   25   24   24   29   26                                       
CONECT   26   28   28   25   27                                       
CONECT   27   26                                                      
CONECT   28   26   26                                                 
CONECT   29   30   30   25   56                                       
CONECT   30   22   29   29   57                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
