COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.299   0.230  -0.050  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.167  -1.539   0.124  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.008   0.693  -0.305  1.00  0.00           C  
HETATM    4  C   UNL     1       0.706  -3.801   0.557  1.00  0.00           C  
HETATM    5  C   UNL     1       4.458   0.190   0.683  1.00  0.00           C  
HETATM    6  C   UNL     1       6.175   1.910   0.083  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.978   0.532   1.303  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.600   0.051  -0.007  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.669  -0.978  -0.662  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.372  -0.271  -0.996  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.817   0.645   0.006  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.578   1.027   1.086  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.446   1.156  -0.145  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.510  -1.112   0.289  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.459  -1.982   0.375  1.00  0.00           C  
HETATM   16  C   UNL     1       0.059  -0.192  -0.218  1.00  0.00           C  
HETATM   17  C   UNL     1       1.445   0.240  -0.477  1.00  0.00           C  
HETATM   18  C   UNL     1       2.162  -1.952  -0.043  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.774   2.136  -0.671  1.00  0.00           C  
HETATM   20  C   UNL     1       3.817  -0.278  -0.624  1.00  0.00           C  
HETATM   21  C   UNL     1       5.884   0.602   0.424  1.00  0.00           C  
HETATM   22  C   UNL     1       7.482   2.286  -0.160  1.00  0.00           C  
HETATM   23  C   UNL     1       8.500   1.357  -0.058  1.00  0.00           C  
HETATM   24  C   UNL     1       8.210   0.050   0.290  1.00  0.00           C  
HETATM   25  C   UNL     1       6.902  -0.328   0.527  1.00  0.00           C  
HETATM   26  N   UNL     1       0.918  -2.395   0.203  1.00  0.00           N  
HETATM   27  N   UNL     1       2.430  -0.679  -0.373  1.00  0.00           N  
HETATM   28  O   UNL     1      -5.048   1.875   1.980  1.00  0.00           O  
HETATM   29  O   UNL     1      -4.811  -0.457  -2.056  1.00  0.00           O  
HETATM   30  O   UNL     1       1.695   1.391  -0.776  1.00  0.00           O  
HETATM   31  O   UNL     1       3.086  -2.739   0.038  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.257   2.341  -0.347  1.00  0.00           O  
HETATM   33  H   UNL     1       0.541  -4.383  -0.349  1.00  0.00           H  
HETATM   34  H   UNL     1       1.585  -4.181   1.078  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.165  -3.885   1.207  1.00  0.00           H  
HETATM   36  H   UNL     1       3.900   1.039   1.078  1.00  0.00           H  
HETATM   37  H   UNL     1       4.441  -0.625   1.408  1.00  0.00           H  
HETATM   38  H   UNL     1       5.379   2.636   0.003  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.584   1.341   1.711  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.958  -0.294   2.013  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.566  -0.410   0.197  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.735   0.899  -0.679  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.476  -1.796   0.032  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.127  -1.365  -1.572  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.512  -1.463   0.485  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.635  -3.014   0.637  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.672   2.729   0.237  1.00  0.00           H  
HETATM   48  H   UNL     1       0.137   2.217  -1.263  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.619   2.505  -1.253  1.00  0.00           H  
HETATM   50  H   UNL     1       3.833   0.536  -1.349  1.00  0.00           H  
HETATM   51  H   UNL     1       4.374  -1.128  -1.019  1.00  0.00           H  
HETATM   52  H   UNL     1       7.709   3.307  -0.430  1.00  0.00           H  
HETATM   53  H   UNL     1       9.521   1.651  -0.248  1.00  0.00           H  
HETATM   54  H   UNL     1       9.005  -0.676   0.370  1.00  0.00           H  
HETATM   55  H   UNL     1       6.676  -1.349   0.798  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.139   2.164   1.825  1.00  0.00           H  
CONECT    1   13    3    3   14                                       
CONECT    2   16   16   15   26                                       
CONECT    3   19    1    1   16                                       
CONECT    4   26   33   34   35                                       
CONECT    5   20   21   36   37                                       
CONECT    6   21   21   22   38                                       
CONECT    7   12    8   39   40                                       
CONECT    8    7    9   41   42                                       
CONECT    9    8   10   43   44                                       
CONECT   10   11   29   29    9                                       
CONECT   11   12   12   13   10                                       
CONECT   12   28   11   11    7                                       
CONECT   13   32   32   11    1                                       
CONECT   14    1   15   15   45                                       
CONECT   15   14   14    2   46                                       
CONECT   16    3   17    2    2                                       
CONECT   17   30   30   16   27                                       
CONECT   18   27   26   31   31                                       
CONECT   19    3   47   48   49                                       
CONECT   20   27    5   50   51                                       
CONECT   21   25    5    6    6                                       
CONECT   22   23   23    6   52                                       
CONECT   23   24   22   22   53                                       
CONECT   24   25   25   23   54                                       
CONECT   25   24   24   21   55                                       
CONECT   26    2   18    4                                            
CONECT   27   17   20   18                                            
CONECT   28   12   56                                                 
CONECT   29   10   10                                                 
CONECT   30   17   17                                                 
CONECT   31   18   18                                                 
CONECT   32   13   13                                                 
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   28                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
