COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.578   2.018  -0.128  1.00  0.00           O  
HETATM    2  O   UNL     1      -5.428  -0.376  -0.912  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.050  -3.855  -0.942  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.177  -3.287  -2.173  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.575  -2.066  -2.464  1.00  0.00           C  
HETATM    6  C   UNL     1       0.157  -1.404  -1.524  1.00  0.00           C  
HETATM    7  C   UNL     1       1.722  -0.008   0.468  1.00  0.00           C  
HETATM    8  C   UNL     1       3.102   0.085   0.469  1.00  0.00           C  
HETATM    9  C   UNL     1       3.734   1.299   0.193  1.00  0.00           C  
HETATM   10  C   UNL     1       2.996   2.430  -0.087  1.00  0.00           C  
HETATM   11  C   UNL     1       0.942   1.142   0.184  1.00  0.00           C  
HETATM   12  C   UNL     1       1.594   2.368  -0.094  1.00  0.00           C  
HETATM   13  C   UNL     1       0.818   3.511  -0.377  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.540   3.388  -0.370  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.126   2.143  -0.086  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.598   2.023  -0.081  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.167   0.854   0.186  1.00  0.00           C  
HETATM   18  C   UNL     1       5.860   0.309  -0.205  1.00  0.00           C  
HETATM   19  C   UNL     1       7.362   0.340  -0.087  1.00  0.00           C  
HETATM   20  P   UNL     1      -4.975   0.705   0.191  1.00  0.00           P  
HETATM   21  O   UNL     1      -5.469   0.227   1.647  1.00  0.00           O  
HETATM   22  C   UNL     1       1.188  -1.886   2.006  1.00  0.00           C  
HETATM   23  C   UNL     1       0.571  -3.101   2.283  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.155  -3.756   1.335  1.00  0.00           C  
HETATM   25  C   UNL     1       1.064  -1.301   0.757  1.00  0.00           C  
HETATM   26  C   UNL     1       0.309  -1.959  -0.246  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.307  -3.199   0.054  1.00  0.00           C  
HETATM   28  N   UNL     1      -0.389   1.078   0.177  1.00  0.00           N  
HETATM   29  N   UNL     1       5.131   1.368   0.199  1.00  0.00           N  
HETATM   30  O   UNL     1       5.307  -0.668  -0.664  1.00  0.00           O  
HETATM   31  H   UNL     1      -6.384  -0.507  -0.964  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.522  -4.803  -0.730  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.753  -3.792  -2.935  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.690  -1.636  -3.448  1.00  0.00           H  
HETATM   35  H   UNL     1       0.619  -0.458  -1.763  1.00  0.00           H  
HETATM   36  H   UNL     1       3.697  -0.790   0.685  1.00  0.00           H  
HETATM   37  H   UNL     1       3.497   3.364  -0.298  1.00  0.00           H  
HETATM   38  H   UNL     1       1.287   4.459  -0.592  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.162   4.245  -0.581  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.211   2.885  -0.294  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.553  -0.009   0.399  1.00  0.00           H  
HETATM   42  H   UNL     1       7.674   1.291   0.344  1.00  0.00           H  
HETATM   43  H   UNL     1       7.693  -0.476   0.557  1.00  0.00           H  
HETATM   44  H   UNL     1       7.807   0.225  -1.075  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.112  -0.628   1.922  1.00  0.00           H  
HETATM   46  H   UNL     1       1.761  -1.390   2.774  1.00  0.00           H  
HETATM   47  H   UNL     1       0.681  -3.539   3.264  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.614  -4.706   1.568  1.00  0.00           H  
HETATM   49  H   UNL     1       5.575   2.179   0.494  1.00  0.00           H  
CONECT    1   20   20                                                 
CONECT    2   20   31                                                 
CONECT    3   27   27    4   32                                       
CONECT    4    3    5    5   33                                       
CONECT    5    4    4    6   34                                       
CONECT    6   26   26    5   35                                       
CONECT    7   25   11    8    8                                       
CONECT    8    7    7    9   36                                       
CONECT    9   10   10    8   29                                       
CONECT   10   12    9    9   37                                       
CONECT   11   28   28   12    7                                       
CONECT   12   13   13   11   10                                       
CONECT   13   14   12   12   38                                       
CONECT   14   15   15   13   39                                       
CONECT   15   16   14   14   28                                       
CONECT   16   17   17   15   40                                       
CONECT   17   20   16   16   41                                       
CONECT   18   29   30   30   19                                       
CONECT   19   18   42   43   44                                       
CONECT   20    1    1   21    2                                       
CONECT   20   17                                                      
CONECT   21   20   45                                                 
CONECT   22   23   25   25   46                                       
CONECT   23   24   24   22   47                                       
CONECT   24   23   23   27   48                                       
CONECT   25   22   22   26    7                                       
CONECT   26   27   25    6    6                                       
CONECT   27   24    3    3   26                                       
CONECT   28   15   11   11                                            
CONECT   29    9   18   49                                            
CONECT   30   18   18                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
