COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.126  -0.796   2.447  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.799  -0.225   1.216  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.515   0.331   1.043  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.622   0.281   2.134  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.045  -0.313   3.323  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.102  -0.375   4.497  1.00  0.00           C  
HETATM    7  C   UNL     1       3.062   0.692   1.502  1.00  0.00           C  
HETATM    8  C   UNL     1       4.066  -0.319   1.012  1.00  0.00           C  
HETATM    9  C   UNL     1       5.921  -0.977  -0.412  1.00  0.00           C  
HETATM   10  C   UNL     1       7.773  -2.832  -1.306  1.00  0.00           C  
HETATM   11  C   UNL     1       6.866  -3.183  -0.322  1.00  0.00           C  
HETATM   12  C   UNL     1       5.940  -2.264   0.127  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.118   0.949  -0.241  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.842   2.316  -0.306  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.472   2.885  -1.506  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.373   2.105  -2.644  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.543   0.734  -0.002  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.780  -0.205   0.115  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.831  -1.227  -0.762  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.821  -1.140  -1.820  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.728  -2.381  -2.709  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.087  -3.538  -1.950  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.033  -4.759  -2.691  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.011   0.166  -1.391  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.645   0.749  -2.587  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.180   4.334  -1.577  1.00  0.00           N1+
HETATM   27  O   UNL     1      -0.266   5.023  -0.576  1.00  0.00           O1-
HETATM   28  O   UNL     1       0.147   4.839  -2.636  1.00  0.00           O  
HETATM   29  N   UNL     1      -2.256  -0.820   3.436  1.00  0.00           N  
HETATM   30  C   UNL     1      -4.496  -1.390   2.649  1.00  0.00           C  
HETATM   31  C   UNL     1       0.736   0.845   2.018  1.00  0.00           C  
HETATM   32  O   UNL     1       0.937   2.007   2.307  1.00  0.00           O  
HETATM   33  O   UNL     1       1.753   0.070   1.592  1.00  0.00           O  
HETATM   34  C   UNL     1       4.937   0.015   0.069  1.00  0.00           C  
HETATM   35  C   UNL     1       7.756  -1.559  -1.848  1.00  0.00           C  
HETATM   36  C   UNL     1       6.839  -0.629  -1.403  1.00  0.00           C  
HETATM   37  H   UNL     1      -0.225   0.519   5.109  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.325  -1.258   5.096  1.00  0.00           H  
HETATM   39  H   UNL     1       0.925  -0.430   4.136  1.00  0.00           H  
HETATM   40  H   UNL     1       3.361   1.053   2.486  1.00  0.00           H  
HETATM   41  H   UNL     1       3.020   1.530   0.806  1.00  0.00           H  
HETATM   42  H   UNL     1       4.076  -1.316   1.427  1.00  0.00           H  
HETATM   43  H   UNL     1       8.493  -3.556  -1.657  1.00  0.00           H  
HETATM   44  H   UNL     1       6.882  -4.180   0.094  1.00  0.00           H  
HETATM   45  H   UNL     1       5.233  -2.539   0.895  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.919   2.926   0.582  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.088   2.556  -3.583  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.817  -1.080  -1.382  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.634  -0.249  -2.420  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.409  -2.275  -3.553  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.708  -2.490  -3.076  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.720  -4.702  -3.536  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.018  -4.916  -3.059  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.319  -5.589  -2.045  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.218  -0.893  -1.346  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.567   0.146  -3.479  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.173  -0.622   3.024  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.870  -1.772   1.699  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.436  -2.205   3.370  1.00  0.00           H  
HETATM   60  H   UNL     1       4.927   1.012  -0.346  1.00  0.00           H  
HETATM   61  H   UNL     1       8.467  -1.291  -2.615  1.00  0.00           H  
HETATM   62  H   UNL     1       6.832   0.367  -1.822  1.00  0.00           H  
CONECT    1    2   30   29   29                                       
CONECT    2   18    3    3    1                                       
CONECT    3   13    2    2    4                                       
CONECT    4    3   31    5    5                                       
CONECT    5    4    4   29    6                                       
CONECT    6    5   37   38   39                                       
CONECT    7    8   33   40   41                                       
CONECT    8   34   34    7   42                                       
CONECT    9   12   36   36   34                                       
CONECT   10   11   35   35   43                                       
CONECT   11   12   12   10   44                                       
CONECT   12   11   11    9   45                                       
CONECT   13   24   24   14    3                                       
CONECT   14   15   15   13   46                                       
CONECT   15   16   26   14   14                                       
CONECT   16   25   25   15   47                                       
CONECT   17   18   18                                                 
CONECT   18   17   17   19    2                                       
CONECT   19   20   18                                                 
CONECT   20   21   19   48   49                                       
CONECT   21   22   20   50   51                                       
CONECT   22   23   21                                                 
CONECT   23   22   52   53   54                                       
CONECT   24   25   13   13   55                                       
CONECT   25   16   16   24   56                                       
CONECT   26   28   28   27   15                                       
CONECT   27   26                                                      
CONECT   28   26   26                                                 
CONECT   29    1    1    5                                            
CONECT   30    1   57   58   59                                       
CONECT   31   33    4   32   32                                       
CONECT   32   31   31                                                 
CONECT   33    7   31                                                 
CONECT   34    9    8    8   60                                       
CONECT   35   10   10   36   61                                       
CONECT   36    9    9   35   62                                       
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   14                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   34                                                      
CONECT   61   35                                                      
CONECT   62   36                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
