COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.692   0.250   0.705  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.997   0.244   0.588  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.020  -0.004  -1.117  1.00  0.00           C  
HETATM    4  C   UNL     1       0.134  -2.283   0.487  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.051   0.438  -2.157  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.954  -0.744  -2.514  1.00  0.00           C  
HETATM    7  C   UNL     1       0.254  -0.005   1.388  1.00  0.00           C  
HETATM    8  C   UNL     1       0.391   1.041   0.609  1.00  0.00           C  
HETATM    9  C   UNL     1       1.349   2.133   1.012  1.00  0.00           C  
HETATM   10  C   UNL     1       1.056  -0.065   2.662  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.025  -3.564   0.981  1.00  0.00           C  
HETATM   12  C   UNL     1       0.707  -4.607   0.447  1.00  0.00           C  
HETATM   13  C   UNL     1       1.598  -4.370  -0.583  1.00  0.00           C  
HETATM   14  C   UNL     1       1.757  -3.089  -1.078  1.00  0.00           C  
HETATM   15  C   UNL     1       1.026  -2.045  -0.542  1.00  0.00           C  
HETATM   16  C   UNL     1       2.705   1.857   0.417  1.00  0.00           C  
HETATM   17  C   UNL     1       3.026   2.354  -0.832  1.00  0.00           C  
HETATM   18  C   UNL     1       4.270   2.101  -1.378  1.00  0.00           C  
HETATM   19  C   UNL     1       5.194   1.350  -0.675  1.00  0.00           C  
HETATM   20  C   UNL     1       4.873   0.853   0.574  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.382   1.269   1.527  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.465   1.210   1.301  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.492   1.832   1.870  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.321   1.171  -0.576  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.726  -0.705   0.052  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.668  -1.146   1.066  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.901   1.573  -1.582  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.331   0.928  -3.415  1.00  0.00           C  
HETATM   29  C   UNL     1       3.631   1.110   1.122  1.00  0.00           C  
HETATM   30  H   UNL     1      -0.301  -0.683  -1.576  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.689  -0.430  -3.255  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.349  -1.553  -2.924  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.468  -1.093  -1.618  1.00  0.00           H  
HETATM   34  H   UNL     1       0.980   3.092   0.648  1.00  0.00           H  
HETATM   35  H   UNL     1       1.428   2.164   2.099  1.00  0.00           H  
HETATM   36  H   UNL     1       1.739   0.784   2.702  1.00  0.00           H  
HETATM   37  H   UNL     1       0.382  -0.028   3.518  1.00  0.00           H  
HETATM   38  H   UNL     1       1.627  -0.993   2.689  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.722  -3.749   1.786  1.00  0.00           H  
HETATM   40  H   UNL     1       0.582  -5.608   0.833  1.00  0.00           H  
HETATM   41  H   UNL     1       2.170  -5.185  -1.000  1.00  0.00           H  
HETATM   42  H   UNL     1       2.454  -2.904  -1.882  1.00  0.00           H  
HETATM   43  H   UNL     1       1.151  -1.044  -0.929  1.00  0.00           H  
HETATM   44  H   UNL     1       2.305   2.941  -1.382  1.00  0.00           H  
HETATM   45  H   UNL     1       4.521   2.489  -2.355  1.00  0.00           H  
HETATM   46  H   UNL     1       6.166   1.151  -1.103  1.00  0.00           H  
HETATM   47  H   UNL     1       5.595   0.266   1.123  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.492   1.532   1.809  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.356   2.023  -1.040  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.266  -1.577  -0.317  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.161  -1.481   1.979  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.701   1.154  -0.971  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.275   2.220  -0.967  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.333   2.153  -2.398  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.688   1.770  -3.160  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.725   0.119  -3.825  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.066   1.243  -4.156  1.00  0.00           H  
HETATM   58  H   UNL     1       3.382   0.725   2.100  1.00  0.00           H  
CONECT    1   25    2    2   21                                       
CONECT    2    1    1   22                                            
CONECT    3   30   24   25    5                                       
CONECT    4   11   11   15   26                                       
CONECT    5   27    6   28    3                                       
CONECT    6    5   31   32   33                                       
CONECT    7    8    8   10   26                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   16   34   35                                       
CONECT   10    7   36   37   38                                       
CONECT   11    4    4   12   39                                       
CONECT   12   11   13   13   40                                       
CONECT   13   12   12   14   41                                       
CONECT   14   13   15   15   42                                       
CONECT   15    4   14   14   43                                       
CONECT   16    9   17   17   29                                       
CONECT   17   16   16   18   44                                       
CONECT   18   17   19   19   45                                       
CONECT   19   18   18   20   46                                       
CONECT   20   19   29   29   47                                       
CONECT   21   48   23    1                                            
CONECT   22    2   23   23                                            
CONECT   23   22   22   21                                            
CONECT   24   49    8    3                                            
CONECT   25   50    3   26    1                                       
CONECT   26   51   25    7    4                                       
CONECT   27    5   52   53   54                                       
CONECT   28    5   55   56   57                                       
CONECT   29   16   20   20   58                                       
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
