COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.758  -0.009   0.045  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.785  -1.514  -1.705  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.375  -0.240  -0.412  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.770  -0.688  -1.268  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.089  -1.299  -1.284  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.045   0.363  -0.397  1.00  0.00           C  
HETATM    7  C   UNL     1       0.402   1.071  -0.337  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.146   2.237   0.878  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.195   2.601   1.371  1.00  0.00           O  
HETATM   10  C   UNL     1       2.495   2.451   0.315  1.00  0.00           C  
HETATM   11  C   UNL     1       3.353   1.708  -0.627  1.00  0.00           C  
HETATM   12  C   UNL     1       2.975   1.574  -1.966  1.00  0.00           C  
HETATM   13  C   UNL     1       3.783   0.878  -2.840  1.00  0.00           C  
HETATM   14  C   UNL     1       4.965   0.312  -2.395  1.00  0.00           C  
HETATM   15  C   UNL     1       5.346   0.440  -1.070  1.00  0.00           C  
HETATM   16  C   UNL     1       4.551   1.138  -0.186  1.00  0.00           C  
HETATM   17  C   UNL     1       1.139   2.180   0.377  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.341   0.585   0.036  1.00  0.00           C  
HETATM   19  C   UNL     1       0.174   2.881   1.113  1.00  0.00           C  
HETATM   20  C   UNL     1       0.938  -0.269   0.098  1.00  0.00           C  
HETATM   21  C   UNL     1       1.711  -1.018  -0.768  1.00  0.00           C  
HETATM   22  C   UNL     1       2.203  -2.247  -0.369  1.00  0.00           C  
HETATM   23  C   UNL     1       1.921  -2.726   0.896  1.00  0.00           C  
HETATM   24  C   UNL     1       1.148  -1.977   1.763  1.00  0.00           C  
HETATM   25  C   UNL     1       0.661  -0.745   1.366  1.00  0.00           C  
HETATM   26  N   UNL     1       3.040   3.410   1.128  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.009   1.195   0.042  1.00  0.00           N  
HETATM   28  N   UNL     1       2.447  -4.043   1.323  1.00  0.00           N1+
HETATM   29  O   UNL     1      -5.086  -2.113  -1.716  1.00  0.00           O  
HETATM   30  O   UNL     1      -6.654  -0.732  -0.342  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.026   1.000   0.897  1.00  0.00           O  
HETATM   32  O   UNL     1       0.380   3.849   1.823  1.00  0.00           O  
HETATM   33  O   UNL     1       2.198  -4.465   2.438  1.00  0.00           O1-
HETATM   34  O   UNL     1       3.128  -4.703   0.559  1.00  0.00           O  
HETATM   35  H   UNL     1      -2.564  -2.327  -2.381  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.757  -0.857  -1.602  1.00  0.00           H  
HETATM   37  H   UNL     1       0.510   1.184  -1.415  1.00  0.00           H  
HETATM   38  H   UNL     1       2.053   2.015  -2.315  1.00  0.00           H  
HETATM   39  H   UNL     1       3.493   0.774  -3.875  1.00  0.00           H  
HETATM   40  H   UNL     1       5.594  -0.232  -3.084  1.00  0.00           H  
HETATM   41  H   UNL     1       6.269  -0.005  -0.730  1.00  0.00           H  
HETATM   42  H   UNL     1       4.849   1.237   0.848  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.554   1.403   0.709  1.00  0.00           H  
HETATM   44  H   UNL     1       1.931  -0.643  -1.757  1.00  0.00           H  
HETATM   45  H   UNL     1       2.807  -2.832  -1.047  1.00  0.00           H  
HETATM   46  H   UNL     1       0.928  -2.351   2.752  1.00  0.00           H  
HETATM   47  H   UNL     1       0.057  -0.160   2.043  1.00  0.00           H  
HETATM   48  H   UNL     1       3.990   3.599   1.085  1.00  0.00           H  
HETATM   49  H   UNL     1       2.476   3.898   1.747  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.948   1.112   1.168  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.510  -1.816  -2.533  1.00  0.00           H  
CONECT    1   30   30   31    3                                       
CONECT    2    5    5    4   35                                       
CONECT    3    1    5   18   18                                       
CONECT    4    2    6    6   36                                       
CONECT    5   29    3    2    2                                       
CONECT    6   18    4    4   27                                       
CONECT    7   27   20   17   37                                       
CONECT    8   27    9    9   19                                       
CONECT    9    8    8                                                 
CONECT   10   17   17   11   26                                       
CONECT   11   16   10   12   12                                       
CONECT   12   11   11   13   38                                       
CONECT   13   14   14   12   39                                       
CONECT   14   15   13   13   40                                       
CONECT   15   16   16   14   41                                       
CONECT   16   15   15   11   42                                       
CONECT   17    7   19   10   10                                       
CONECT   18    3    3    6   43                                       
CONECT   19    8   17   32   32                                       
CONECT   20   25   25   21    7                                       
CONECT   21   22   22   20   44                                       
CONECT   22   23   21   21   45                                       
CONECT   23   28   24   24   22                                       
CONECT   24   23   23   25   46                                       
CONECT   25   24   20   20   47                                       
CONECT   26   10   48   49                                            
CONECT   27    6    8    7                                            
CONECT   28   33   23   34   34                                       
CONECT   29    5   51                                                 
CONECT   30    1    1                                                 
CONECT   31    1   50                                                 
CONECT   32   19   19                                                 
CONECT   33   28                                                      
CONECT   34   28   28                                                 
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   31                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
