COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.130   1.077   0.038  1.00  0.00           C  
HETATM    2  C   UNL     1       0.082  -0.318  -0.125  1.00  0.00           C  
HETATM    3  C   UNL     1       1.262  -1.059  -0.221  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.848  -2.079  -0.338  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.048   0.460  -0.015  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.341  -0.683  -0.161  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.513   0.632   0.022  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.502  -0.311  -0.080  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.355  -1.788  -0.271  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.732   0.354   0.022  1.00  0.00           C  
HETATM   11  O   UNL     1       5.919  -0.108  -0.181  1.00  0.00           O  
HETATM   12  C   UNL     1       4.716   0.045  -0.144  1.00  0.00           C  
HETATM   13  N   UNL     1       3.787  -0.920  -0.237  1.00  0.00           N  
HETATM   14  C   UNL     1       4.100  -2.342  -0.398  1.00  0.00           C  
HETATM   15  C   UNL     1       4.229  -2.995   0.980  1.00  0.00           C  
HETATM   16  C   UNL     1       3.984   1.360   0.014  1.00  0.00           C  
HETATM   17  C   UNL     1       4.345   2.017   1.348  1.00  0.00           C  
HETATM   18  C   UNL     1       4.310   2.298  -1.150  1.00  0.00           C  
HETATM   19  C   UNL     1       2.522   0.974  -0.007  1.00  0.00           C  
HETATM   20  C   UNL     1       1.367   1.712   0.095  1.00  0.00           C  
HETATM   21  C   UNL     1       2.487  -0.412  -0.164  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.168   1.526   0.102  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.131  -2.355   0.389  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.089  -0.298  -0.034  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.509   1.633   0.174  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.128   1.849   0.177  1.00  0.00           N  
HETATM   27  H   UNL     1       1.220  -2.132  -0.340  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.005  -2.260  -1.401  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.088  -2.774   0.021  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.235  -2.283   0.140  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.306  -1.999  -1.339  1.00  0.00           H  
HETATM   32  H   UNL     1       3.301  -2.829  -0.957  1.00  0.00           H  
HETATM   33  H   UNL     1       5.040  -2.449  -0.939  1.00  0.00           H  
HETATM   34  H   UNL     1       5.027  -2.507   1.539  1.00  0.00           H  
HETATM   35  H   UNL     1       3.289  -2.888   1.522  1.00  0.00           H  
HETATM   36  H   UNL     1       4.462  -4.053   0.861  1.00  0.00           H  
HETATM   37  H   UNL     1       5.414   2.227   1.372  1.00  0.00           H  
HETATM   38  H   UNL     1       3.789   2.949   1.456  1.00  0.00           H  
HETATM   39  H   UNL     1       4.088   1.344   2.166  1.00  0.00           H  
HETATM   40  H   UNL     1       4.029   1.823  -2.089  1.00  0.00           H  
HETATM   41  H   UNL     1       3.755   3.229  -1.033  1.00  0.00           H  
HETATM   42  H   UNL     1       5.379   2.511  -1.156  1.00  0.00           H  
HETATM   43  H   UNL     1       1.420   2.783   0.220  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.430   2.453   0.217  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.254  -3.434   0.476  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.056  -1.938   1.393  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.399  -0.580   0.972  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.812   0.401  -0.454  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.038  -1.189  -0.661  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.684   2.705   0.273  1.00  0.00           H  
CONECT    1    2    2   20   22                                       
CONECT    2    1    1    3    6                                       
CONECT    3    2   21   21   27                                       
CONECT    4    6   23   28   29                                       
CONECT    5    6    6    7   22                                       
CONECT    6    2    4    5    5                                       
CONECT    7    5    8    8   26                                       
CONECT    8    7    7    9   10                                       
CONECT    9    8   23   30   31                                       
CONECT   10    8   24   25   25                                       
CONECT   11   12   12                                                 
CONECT   12   11   11   13   16                                       
CONECT   13   12   14   21                                            
CONECT   14   13   15   32   33                                       
CONECT   15   14   34   35   36                                       
CONECT   16   12   17   18   19                                       
CONECT   17   16   37   38   39                                       
CONECT   18   16   40   41   42                                       
CONECT   19   16   20   20   21                                       
CONECT   20    1   19   19   43                                       
CONECT   21    3    3   13   19                                       
CONECT   22    1    5   44                                            
CONECT   23    4    9   45   46                                       
CONECT   24   10   47   48   49                                       
CONECT   25   10   10   26                                            
CONECT   26    7   25   50                                            
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
