COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.779   1.624   0.591  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.138   0.734  -0.479  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.098   2.228  -0.465  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.886  -0.204  -0.277  1.00  0.00           C  
HETATM    5  C   UNL     1       0.581  -0.034  -0.052  1.00  0.00           C  
HETATM    6  N   UNL     1       1.395  -1.108  -0.076  1.00  0.00           N  
HETATM    7  C   UNL     1       2.781  -0.937   0.004  1.00  0.00           C  
HETATM    8  C   UNL     1       3.384   0.204  -0.525  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.516  -0.704  -0.234  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.194  -1.416  -1.206  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.210  -3.342   0.217  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.181  -1.312   0.962  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.269   4.542   0.466  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.762   3.101   0.605  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.281   3.060   0.420  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.678   0.879  -0.402  1.00  0.00           N  
HETATM   17  O   UNL     1      -1.365  -1.317  -0.347  1.00  0.00           O  
HETATM   18  O   UNL     1       1.040   1.071   0.152  1.00  0.00           O  
HETATM   19  C   UNL     1       3.573  -1.898   0.617  1.00  0.00           C  
HETATM   20  N   UNL     1       4.880  -1.743   0.697  1.00  0.00           N  
HETATM   21  C   UNL     1       5.486  -0.675   0.201  1.00  0.00           C  
HETATM   22  N   UNL     1       6.869  -0.557   0.310  1.00  0.00           N  
HETATM   23  C   UNL     1       4.756   0.331  -0.422  1.00  0.00           C  
HETATM   24  C   UNL     1       5.453   1.546  -0.979  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.541  -2.735  -0.980  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.528  -2.631   1.187  1.00  0.00           C  
HETATM   27  H   UNL     1      -4.863   1.599   0.482  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.504   1.258   1.580  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.487   1.040  -1.466  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.278   2.658  -1.451  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.025   2.173  -0.279  1.00  0.00           H  
HETATM   32  H   UNL     1       1.019  -2.000  -0.150  1.00  0.00           H  
HETATM   33  H   UNL     1       2.792   0.970  -1.004  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.452  -0.942  -2.141  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.481  -4.372   0.393  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.648  -0.757   1.719  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.527   4.921  -0.522  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.741   5.163   1.228  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.187   4.570   0.595  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.505   2.722   1.594  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.534   3.417  -0.578  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.754   3.700   1.165  1.00  0.00           H  
HETATM   43  H   UNL     1       3.113  -2.782   1.033  1.00  0.00           H  
HETATM   44  H   UNL     1       7.383  -1.254   0.746  1.00  0.00           H  
HETATM   45  H   UNL     1       7.318   0.223  -0.052  1.00  0.00           H  
HETATM   46  H   UNL     1       5.510   2.317  -0.211  1.00  0.00           H  
HETATM   47  H   UNL     1       6.460   1.273  -1.296  1.00  0.00           H  
HETATM   48  H   UNL     1       4.894   1.925  -1.835  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.070  -3.292  -1.740  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.266  -3.106   2.121  1.00  0.00           H  
CONECT    1   15    2   27   28                                       
CONECT    2   16    1    9   29                                       
CONECT    3   14   16   30   31                                       
CONECT    4   17   17    5   16                                       
CONECT    5    4    6   18   18                                       
CONECT    6    5    7   32                                            
CONECT    7    6    8    8   19                                       
CONECT    8    7    7   23   33                                       
CONECT    9    2   12   12   10                                       
CONECT   10    9   25   25   34                                       
CONECT   11   26   26   25   35                                       
CONECT   12    9    9   26   36                                       
CONECT   13   14   37   38   39                                       
CONECT   14   13    3   15   40                                       
CONECT   15   14    1   41   42                                       
CONECT   16    4    3    2                                            
CONECT   17    4    4                                                 
CONECT   18    5    5                                                 
CONECT   19    7   20   20   43                                       
CONECT   20   19   19   21                                            
CONECT   21   23   23   20   22                                       
CONECT   22   21   44   45                                            
CONECT   23    8   24   21   21                                       
CONECT   24   23   46   47   48                                       
CONECT   25   10   10   11   49                                       
CONECT   26   12   11   11   50                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
