COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.998  -0.832   0.259  1.00  0.00           C  
HETATM    2  C   UNL     1       8.828   0.152   0.321  1.00  0.00           C  
HETATM    3  C   UNL     1       7.513  -0.605   0.121  1.00  0.00           C  
HETATM    4  C   UNL     1       6.344   0.380   0.183  1.00  0.00           C  
HETATM    5  C   UNL     1       5.029  -0.377  -0.017  1.00  0.00           C  
HETATM    6  C   UNL     1       3.859   0.607   0.044  1.00  0.00           C  
HETATM    7  C   UNL     1       2.545  -0.150  -0.156  1.00  0.00           C  
HETATM    8  C   UNL     1       1.375   0.835  -0.094  1.00  0.00           C  
HETATM    9  N   UNL     1       0.116   0.110  -0.285  1.00  0.00           N1+
HETATM   10  C   UNL     1      -1.016   0.756  -0.270  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.118   2.109  -0.082  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.530   2.504  -0.194  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.267   1.204  -0.545  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.228   0.160  -0.445  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.539  -1.276  -0.480  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.982  -1.646  -1.787  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.656  -1.529   0.543  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.128  -2.871   0.409  1.00  0.00           O  
HETATM   19  C   UNL     1      -4.810  -0.556   0.297  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.870  -0.840   1.213  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.340   0.891   0.502  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.447   1.780   0.333  1.00  0.00           O  
HETATM   23  H   UNL     1      -0.378   2.710   0.097  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.891   2.901   0.754  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.657   3.239  -0.989  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.685   1.246  -1.551  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.922   1.011   1.501  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.266  -1.380   1.550  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.449  -3.543   0.555  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.173  -0.678  -0.723  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.227  -1.735   1.136  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.165   1.638   0.965  1.00  0.00           H  
HETATM   33  H   UNL     1      10.934  -0.293   0.402  1.00  0.00           H  
HETATM   34  H   UNL     1       9.885  -1.580   1.045  1.00  0.00           H  
HETATM   35  H   UNL     1      10.007  -1.326  -0.713  1.00  0.00           H  
HETATM   36  H   UNL     1       0.126  -0.850  -0.424  1.00  0.00           H  
HETATM   37  H   UNL     1       8.819   0.645   1.293  1.00  0.00           H  
HETATM   38  H   UNL     1       8.940   0.899  -0.465  1.00  0.00           H  
HETATM   39  H   UNL     1       7.522  -1.098  -0.851  1.00  0.00           H  
HETATM   40  H   UNL     1       7.401  -1.352   0.907  1.00  0.00           H  
HETATM   41  H   UNL     1       6.335   0.873   1.155  1.00  0.00           H  
HETATM   42  H   UNL     1       6.456   1.127  -0.603  1.00  0.00           H  
HETATM   43  H   UNL     1       5.038  -0.870  -0.989  1.00  0.00           H  
HETATM   44  H   UNL     1       4.917  -1.125   0.768  1.00  0.00           H  
HETATM   45  H   UNL     1       3.851   1.100   1.016  1.00  0.00           H  
HETATM   46  H   UNL     1       3.972   1.354  -0.741  1.00  0.00           H  
HETATM   47  H   UNL     1       2.554  -0.643  -1.128  1.00  0.00           H  
HETATM   48  H   UNL     1       2.433  -0.897   0.630  1.00  0.00           H  
HETATM   49  H   UNL     1       1.366   1.328   0.878  1.00  0.00           H  
HETATM   50  H   UNL     1       1.487   1.582  -0.879  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.653  -1.853  -0.212  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.203  -2.583  -1.877  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    1    3   37   38                                       
CONECT    3   40    2    4   39                                       
CONECT    4   41   42    3    5                                       
CONECT    5   43   44    4    6                                       
CONECT    6   45   46    5    7                                       
CONECT    7   47   48    6    8                                       
CONECT    8   49   50    7    9                                       
CONECT    9    8   10   10   36                                       
CONECT   10    9    9   11   14                                       
CONECT   11   10   12   23                                            
CONECT   12   11   13   24   25                                       
CONECT   13   12   14   21   26                                       
CONECT   14   10   13   15                                            
CONECT   15   51   14   16   17                                       
CONECT   16   52   15                                                 
CONECT   17   15   18   19   28                                       
CONECT   18   17   29                                                 
CONECT   19   17   20   21   30                                       
CONECT   20   19   31                                                 
CONECT   21   13   19   22   27                                       
CONECT   22   21   32                                                 
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   21                                                      
CONECT   28   17                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
CONECT   31   20                                                      
CONECT   32   22                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    9                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
