COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.007   0.424  -1.331  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.992  -0.503  -1.145  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.670  -0.930   0.135  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.352  -0.425   1.224  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.363   0.506   1.039  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.689   0.930  -0.241  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.571  -1.942   0.337  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.271  -1.270   0.267  1.00  0.00           N  
HETATM    9  C   UNL     1       0.864  -1.982   0.420  1.00  0.00           C  
HETATM   10  C   UNL     1       2.180  -1.303   0.349  1.00  0.00           C  
HETATM   11  N   UNL     1       2.229   0.007   0.134  1.00  0.00           N  
HETATM   12  C   UNL     1       3.376   0.655   0.063  1.00  0.00           C  
HETATM   13  C   UNL     1       4.594  -0.031   0.209  1.00  0.00           C  
HETATM   14  C   UNL     1       4.572  -1.410   0.442  1.00  0.00           C  
HETATM   15  C   UNL     1       3.346  -2.047   0.509  1.00  0.00           C  
HETATM   16  O   UNL     1      -5.034   1.004   2.111  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.999   1.927   1.602  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.321  -1.000  -2.217  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.882  -0.385  -3.378  1.00  0.00           C  
HETATM   20  C   UNL     1       5.838   0.674   0.131  1.00  0.00           C  
HETATM   21  N   UNL     1       6.825   1.233   0.070  1.00  0.00           N  
HETATM   22  O   UNL     1       3.379   1.991  -0.159  1.00  0.00           O  
HETATM   23  C   UNL     1       2.013   2.395  -0.269  1.00  0.00           C  
HETATM   24  C   UNL     1       1.946   3.903  -0.521  1.00  0.00           C  
HETATM   25  O   UNL     1       0.808  -3.179   0.616  1.00  0.00           O  
HETATM   26  H   UNL     1      -4.261   0.754  -2.327  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.098  -0.755   2.221  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.476   1.655  -0.386  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.630  -2.702  -0.442  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.685  -2.412   1.313  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.226  -0.314   0.110  1.00  0.00           H  
HETATM   32  H   UNL     1       5.491  -1.964   0.563  1.00  0.00           H  
HETATM   33  H   UNL     1       3.293  -3.112   0.685  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.565   2.354   2.430  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.490   2.724   1.061  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.679   1.406   0.928  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.943  -0.627  -3.440  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.759   0.696  -3.312  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.373  -0.755  -4.268  1.00  0.00           H  
HETATM   40  H   UNL     1       1.488   2.158   0.656  1.00  0.00           H  
HETATM   41  H   UNL     1       1.544   1.867  -1.099  1.00  0.00           H  
HETATM   42  H   UNL     1       2.471   4.140  -1.447  1.00  0.00           H  
HETATM   43  H   UNL     1       0.904   4.211  -0.605  1.00  0.00           H  
HETATM   44  H   UNL     1       2.415   4.431   0.309  1.00  0.00           H  
CONECT    1    2    2    6   26                                       
CONECT    2    1    1    3   18                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5   27                                       
CONECT    5    4    6    6   16                                       
CONECT    6    1    5    5   28                                       
CONECT    7    3    8   29   30                                       
CONECT    8    7    9   31                                            
CONECT    9    8   10   25   25                                       
CONECT   10    9   11   15   15                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   13   22                                       
CONECT   13   12   14   14   20                                       
CONECT   14   13   13   15   32                                       
CONECT   15   10   10   14   33                                       
CONECT   16    5   17                                                 
CONECT   17   16   34   35   36                                       
CONECT   18    2   19                                                 
CONECT   19   18   37   38   39                                       
CONECT   20   13   21   21   21                                       
CONECT   21   20   20   20                                            
CONECT   22   12   23                                                 
CONECT   23   22   24   40   41                                       
CONECT   24   23   42   43   44                                       
CONECT   25    9    9                                                 
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
