COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.003   2.237  -1.122  1.00  0.00           O  
HETATM    2  C   UNL     1       5.319   3.741   1.149  1.00  0.00           C  
HETATM    3  N   UNL     1       5.281   1.522   0.122  1.00  0.00           N  
HETATM    4  C   UNL     1       5.784   2.889  -0.034  1.00  0.00           C  
HETATM    5  N   UNL     1       5.204  -0.526   0.639  1.00  0.00           N  
HETATM    6  C   UNL     1       5.246   3.486  -1.335  1.00  0.00           C  
HETATM    7  N   UNL     1       5.924   0.540   0.647  1.00  0.00           N  
HETATM    8  C   UNL     1       4.061   1.081  -0.259  1.00  0.00           C  
HETATM    9  N   UNL     1       2.097  -3.284  -0.880  1.00  0.00           N  
HETATM   10  C   UNL     1       4.016  -0.241   0.077  1.00  0.00           C  
HETATM   11  N   UNL     1       4.391  -2.830  -1.038  1.00  0.00           N  
HETATM   12  C   UNL     1       2.883  -1.177  -0.135  1.00  0.00           C  
HETATM   13  N   UNL     1      -5.532   0.243   0.201  1.00  0.00           N  
HETATM   14  C   UNL     1       1.587  -0.807   0.211  1.00  0.00           C  
HETATM   15  C   UNL     1       0.555  -1.724  -0.010  1.00  0.00           C  
HETATM   16  C   UNL     1       0.857  -2.966  -0.563  1.00  0.00           C  
HETATM   17  C   UNL     1       3.103  -2.447  -0.688  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.844  -1.379   0.342  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.140  -0.133   0.891  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.444   0.183   1.216  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.455  -0.735   0.998  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.167  -1.974   0.454  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.868  -2.298   0.120  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.877  -0.385   1.356  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.978   0.384   0.427  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.628   0.986  -0.821  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.595   2.137  -1.348  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.924   1.546  -0.105  1.00  0.00           C  
HETATM   29  H   UNL     1       4.229   3.756   1.180  1.00  0.00           H  
HETATM   30  H   UNL     1       5.703   3.316   2.077  1.00  0.00           H  
HETATM   31  H   UNL     1       5.693   4.758   1.034  1.00  0.00           H  
HETATM   32  H   UNL     1       6.874   2.875  -0.064  1.00  0.00           H  
HETATM   33  H   UNL     1       5.620   4.504  -1.450  1.00  0.00           H  
HETATM   34  H   UNL     1       5.577   2.880  -2.178  1.00  0.00           H  
HETATM   35  H   UNL     1       4.156   3.501  -1.304  1.00  0.00           H  
HETATM   36  H   UNL     1       3.280   1.658  -0.732  1.00  0.00           H  
HETATM   37  H   UNL     1       5.119  -2.190  -0.985  1.00  0.00           H  
HETATM   38  H   UNL     1       4.563  -3.737  -1.335  1.00  0.00           H  
HETATM   39  H   UNL     1       1.383   0.163   0.639  1.00  0.00           H  
HETATM   40  H   UNL     1       0.064  -3.679  -0.736  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.351   0.584   1.061  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.674   1.148   1.641  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.961  -2.687   0.287  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.645  -3.263  -0.310  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.879   0.309   2.197  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.416  -1.291   1.631  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.411  -0.596   0.627  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.151   1.039   1.281  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.691   1.144  -0.637  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.501   0.304  -1.662  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.409   1.489  -2.205  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.187   3.128  -1.546  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.064   2.221   0.739  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.858   1.416  -0.294  1.00  0.00           H  
CONECT    1   27   26                                                 
CONECT    2    4   29   30   31                                       
CONECT    3    4    7    8                                            
CONECT    4    6    2    3   32                                       
CONECT    5    7    7   10                                            
CONECT    6    4   33   34   35                                       
CONECT    7    3    5    5                                            
CONECT    8    3   10   10   36                                       
CONECT    9   17   17   16                                            
CONECT   10    8    8    5   12                                       
CONECT   11   17   37   38                                            
CONECT   12   10   14   14   17                                       
CONECT   13   28   24   25                                            
CONECT   14   12   12   15   39                                       
CONECT   15   14   18   16   16                                       
CONECT   16   15   15    9   40                                       
CONECT   17   12   11    9    9                                       
CONECT   18   19   15   23   23                                       
CONECT   19   20   20   18   41                                       
CONECT   20   19   19   21   42                                       
CONECT   21   20   24   22   22                                       
CONECT   22   21   21   23   43                                       
CONECT   23   18   18   22   44                                       
CONECT   24   13   21   45   46                                       
CONECT   25   13   26   47   48                                       
CONECT   26    1   25   49   50                                       
CONECT   27   28    1   51   52                                       
CONECT   28   27   13   53   54                                       
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
