COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.519   1.791  -0.045  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.760   0.603  -0.015  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.037   0.175   0.028  1.00  0.00           N  
HETATM    4  C   UNL     1      -7.135   1.145   0.038  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.471   0.402   0.088  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.631  -0.395  -0.031  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.294   0.347  -0.087  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.165  -0.650  -0.104  1.00  0.00           C  
HETATM    9  O   UNL     1      -1.406  -1.839  -0.073  1.00  0.00           O  
HETATM   10  N   UNL     1       0.112  -0.222  -0.152  1.00  0.00           N  
HETATM   11  C   UNL     1       1.146  -1.128  -0.058  1.00  0.00           C  
HETATM   12  C   UNL     1       1.021  -2.485  -0.020  1.00  0.00           C  
HETATM   13  C   UNL     1       2.309  -3.038   0.076  1.00  0.00           C  
HETATM   14  O   UNL     1       2.577  -4.226   0.133  1.00  0.00           O  
HETATM   15  N   UNL     1       3.197  -2.024   0.095  1.00  0.00           N  
HETATM   16  N   UNL     1       2.481  -0.823   0.006  1.00  0.00           N  
HETATM   17  C   UNL     1       3.058   0.524  -0.012  1.00  0.00           C  
HETATM   18  C   UNL     1       3.909   0.706  -1.286  1.00  0.00           C  
HETATM   19  C   UNL     1       3.944   0.711   1.190  1.00  0.00           C  
HETATM   20  C   UNL     1       3.917   2.156   1.723  1.00  0.00           C  
HETATM   21  C   UNL     1       3.946   3.208   0.598  1.00  0.00           C  
HETATM   22  C   UNL     1       4.909   2.850  -0.502  1.00  0.00           C  
HETATM   23  C   UNL     1       4.130   2.107  -1.610  1.00  0.00           C  
HETATM   24  H   UNL     1      -6.229  -0.776   0.052  1.00  0.00           H  
HETATM   25  H   UNL     1      -7.043   1.788   0.913  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.091   1.752  -0.866  1.00  0.00           H  
HETATM   27  H   UNL     1      -8.515  -0.206   0.992  1.00  0.00           H  
HETATM   28  H   UNL     1      -9.288   1.124   0.096  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.563  -0.241  -0.787  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.670  -1.004   0.872  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.726  -1.038  -0.906  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.254   0.956  -0.991  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.198   0.990   0.788  1.00  0.00           H  
HETATM   34  H   UNL     1       0.303   0.723  -0.252  1.00  0.00           H  
HETATM   35  H   UNL     1       0.094  -3.038  -0.056  1.00  0.00           H  
HETATM   36  H   UNL     1       4.161  -2.111   0.157  1.00  0.00           H  
HETATM   37  H   UNL     1       2.259   1.265   0.003  1.00  0.00           H  
HETATM   38  H   UNL     1       4.874   0.221  -1.138  1.00  0.00           H  
HETATM   39  H   UNL     1       3.399   0.227  -2.122  1.00  0.00           H  
HETATM   40  H   UNL     1       3.613   0.037   1.980  1.00  0.00           H  
HETATM   41  H   UNL     1       4.968   0.454   0.916  1.00  0.00           H  
HETATM   42  H   UNL     1       3.011   2.297   2.312  1.00  0.00           H  
HETATM   43  H   UNL     1       4.782   2.309   2.369  1.00  0.00           H  
HETATM   44  H   UNL     1       2.946   3.299   0.174  1.00  0.00           H  
HETATM   45  H   UNL     1       4.238   4.169   1.021  1.00  0.00           H  
HETATM   46  H   UNL     1       5.351   3.759  -0.911  1.00  0.00           H  
HETATM   47  H   UNL     1       5.694   2.203  -0.109  1.00  0.00           H  
HETATM   48  H   UNL     1       4.693   2.170  -2.541  1.00  0.00           H  
HETATM   49  H   UNL     1       3.164   2.594  -1.750  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    6    3    1    1                                       
CONECT    3    4    2   24                                            
CONECT    4    3    5   25   26                                       
CONECT    5    4   27   28   29                                       
CONECT    6    2    7   30   31                                       
CONECT    7    6    8   32   33                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   34                                            
CONECT   11   10   16   12   12                                       
CONECT   12   11   11   13   35                                       
CONECT   13   12   15   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   36                                            
CONECT   16   11   17   15                                            
CONECT   17   19   18   16   37                                       
CONECT   18   17   23   38   39                                       
CONECT   19   17   20   40   41                                       
CONECT   20   19   21   42   43                                       
CONECT   21   22   20   44   45                                       
CONECT   22   23   21   46   47                                       
CONECT   23   18   22   48   49                                       
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
