COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.135  -1.136   0.567  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.322  -1.795   0.307  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.301  -3.086  -0.187  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.094  -3.717  -0.422  1.00  0.00           C  
HETATM    5  C   UNL     1       1.093  -3.058  -0.163  1.00  0.00           C  
HETATM    6  C   UNL     1       1.072  -1.765   0.326  1.00  0.00           C  
HETATM    7  N   UNL     1      -5.422  -0.375  -0.009  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.597   0.188   0.230  1.00  0.00           C  
HETATM    9  N   UNL     1      -7.655  -0.592   0.682  1.00  0.00           N  
HETATM   10  C   UNL     1      -6.781   1.553   0.033  1.00  0.00           C  
HETATM   11  C   UNL     1       2.366  -1.046   0.609  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.719   2.317  -0.417  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.505   1.688  -0.656  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.392   0.329  -0.439  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.878   3.798  -0.644  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.076  -0.358  -0.696  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.638  -1.108   0.564  1.00  0.00           C  
HETATM   18  N   UNL     1       4.086   1.329   0.464  1.00  0.00           N  
HETATM   19  C   UNL     1       5.139   2.077   0.756  1.00  0.00           C  
HETATM   20  N   UNL     1       5.013   3.115   1.671  1.00  0.00           N  
HETATM   21  C   UNL     1       6.370   1.834   0.154  1.00  0.00           C  
HETATM   22  C   UNL     1       6.480   0.798  -0.755  1.00  0.00           C  
HETATM   23  C   UNL     1       5.352   0.037  -1.034  1.00  0.00           C  
HETATM   24  C   UNL     1       4.163   0.334  -0.400  1.00  0.00           C  
HETATM   25  C   UNL     1       7.795   0.501  -1.429  1.00  0.00           C  
HETATM   26  C   UNL     1       2.936  -0.489  -0.698  1.00  0.00           C  
HETATM   27  N   UNL     1       3.328  -1.984   1.202  1.00  0.00           N  
HETATM   28  H   UNL     1       5.781   3.666   1.889  1.00  0.00           H  
HETATM   29  H   UNL     1       4.157   3.289   2.093  1.00  0.00           H  
HETATM   30  H   UNL     1       7.227   2.445   0.394  1.00  0.00           H  
HETATM   31  H   UNL     1       8.358  -0.214  -0.828  1.00  0.00           H  
HETATM   32  H   UNL     1       7.611   0.079  -2.417  1.00  0.00           H  
HETATM   33  H   UNL     1       8.369   1.423  -1.528  1.00  0.00           H  
HETATM   34  H   UNL     1       5.405  -0.779  -1.739  1.00  0.00           H  
HETATM   35  H   UNL     1       3.203  -1.313  -1.358  1.00  0.00           H  
HETATM   36  H   UNL     1       2.187   0.138  -1.183  1.00  0.00           H  
HETATM   37  H   UNL     1       2.182  -0.226   1.303  1.00  0.00           H  
HETATM   38  H   UNL     1       3.516  -2.753   0.577  1.00  0.00           H  
HETATM   39  H   UNL     1       4.181  -1.511   1.460  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.151  -0.127   0.953  1.00  0.00           H  
HETATM   41  H   UNL     1       2.036  -3.551  -0.346  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.078  -4.726  -0.808  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.229  -3.602  -0.389  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.391  -1.851   0.826  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.524  -0.401   1.386  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.190  -1.065  -1.518  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.323   0.385  -0.957  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.657   2.256  -1.009  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.531  -1.544   0.821  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.517  -0.184   0.858  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.740   2.009   0.228  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.633   4.334   0.273  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.207   4.118  -1.441  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.908   4.015  -0.927  1.00  0.00           H  
CONECT    1    6    2    2   40                                       
CONECT    2    1    1    3   17                                       
CONECT    3    4    4    2   43                                       
CONECT    4    5    3    3   42                                       
CONECT    5    6    6    4   41                                       
CONECT    6   11    1    5    5                                       
CONECT    7   14   14    8                                            
CONECT    8    7    9   10   10                                       
CONECT    9    8   49   50                                            
CONECT   10    8    8   12   51                                       
CONECT   11   26   27    6   37                                       
CONECT   12   13   13   10   15                                       
CONECT   13   14   12   12   48                                       
CONECT   14   16   13    7    7                                       
CONECT   15   12   52   53   54                                       
CONECT   16   17   14   46   47                                       
CONECT   17    2   16   44   45                                       
CONECT   18   19   19   24                                            
CONECT   19   20   21   18   18                                       
CONECT   20   19   28   29                                            
CONECT   21   19   22   22   30                                       
CONECT   22   21   21   25   23                                       
CONECT   23   22   24   24   34                                       
CONECT   24   23   23   18   26                                       
CONECT   25   22   31   32   33                                       
CONECT   26   24   11   35   36                                       
CONECT   27   11   38   39                                            
CONECT   28   20                                                      
CONECT   29   20                                                      
CONECT   30   21                                                      
CONECT   31   25                                                      
CONECT   32   25                                                      
CONECT   33   25                                                      
CONECT   34   23                                                      
CONECT   35   26                                                      
CONECT   36   26                                                      
CONECT   37   11                                                      
CONECT   38   27                                                      
CONECT   39   27                                                      
CONECT   40    1                                                      
CONECT   41    5                                                      
CONECT   42    4                                                      
CONECT   43    3                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   13                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
