COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.096   3.079   1.162  1.00  0.00           N  
HETATM    2  C   UNL     1       4.495  -0.088  -0.665  1.00  0.00           C  
HETATM    3  C   UNL     1       5.723   0.155  -1.261  1.00  0.00           C  
HETATM    4  O   UNL     1       6.277  -0.791  -2.062  1.00  0.00           O  
HETATM    5  N   UNL     1       6.361   1.297  -1.061  1.00  0.00           N  
HETATM    6  C   UNL     1       5.858   2.247  -0.288  1.00  0.00           C  
HETATM    7  N   UNL     1       6.564   3.434  -0.105  1.00  0.00           N  
HETATM    8  C   UNL     1       4.627   2.070   0.344  1.00  0.00           C  
HETATM    9  C   UNL     1       3.933   0.882   0.152  1.00  0.00           C  
HETATM   10  C   UNL     1       3.775  -1.390  -0.906  1.00  0.00           C  
HETATM   11  C   UNL     1       4.239  -2.466   0.108  1.00  0.00           C  
HETATM   12  C   UNL     1       3.024  -3.426   0.140  1.00  0.00           C  
HETATM   13  O   UNL     1       3.250  -4.547  -0.716  1.00  0.00           O  
HETATM   14  C   UNL     1       1.854  -2.571  -0.382  1.00  0.00           C  
HETATM   15  O   UNL     1       2.365  -1.249  -0.632  1.00  0.00           O  
HETATM   16  C   UNL     1       0.744  -2.511   0.670  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.384  -1.816   0.133  1.00  0.00           O  
HETATM   18  O   UNL     1       3.265   4.000   0.387  1.00  0.00           O  
HETATM   19  O   UNL     1       3.343   2.507   2.279  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.413  -0.884   2.241  1.00  0.00           O  
HETATM   21  O   UNL     1      -3.487   1.696   1.045  1.00  0.00           O  
HETATM   22  O   UNL     1      -7.292   0.529  -0.083  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.445  -2.977   1.279  1.00  0.00           O  
HETATM   24  O   UNL     1      -4.827  -0.395   1.498  1.00  0.00           O  
HETATM   25  O   UNL     1      -6.383   2.684  -1.031  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.736  -0.642   0.105  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.887   0.529  -0.850  1.00  0.00           O  
HETATM   28  O   UNL     1      -6.874   0.611  -2.570  1.00  0.00           O  
HETATM   29  P   UNL     1      -1.737  -1.565   0.967  1.00  0.00           P  
HETATM   30  P   UNL     1      -4.002   0.282   0.472  1.00  0.00           P  
HETATM   31  P   UNL     1      -6.379   1.076  -1.111  1.00  0.00           P  
HETATM   32  H   UNL     1       6.029  -0.714  -2.993  1.00  0.00           H  
HETATM   33  H   UNL     1       7.420   3.561  -0.543  1.00  0.00           H  
HETATM   34  H   UNL     1       6.199   4.132   0.460  1.00  0.00           H  
HETATM   35  H   UNL     1       2.977   0.717   0.628  1.00  0.00           H  
HETATM   36  H   UNL     1       3.935  -1.732  -1.929  1.00  0.00           H  
HETATM   37  H   UNL     1       5.131  -2.980  -0.250  1.00  0.00           H  
HETATM   38  H   UNL     1       4.414  -2.026   1.090  1.00  0.00           H  
HETATM   39  H   UNL     1       2.829  -3.759   1.160  1.00  0.00           H  
HETATM   40  H   UNL     1       4.012  -5.087  -0.465  1.00  0.00           H  
HETATM   41  H   UNL     1       1.467  -2.998  -1.308  1.00  0.00           H  
HETATM   42  H   UNL     1       0.449  -3.523   0.945  1.00  0.00           H  
HETATM   43  H   UNL     1       1.108  -1.986   1.553  1.00  0.00           H  
HETATM   44  H   UNL     1       2.877   4.715   0.910  1.00  0.00           H  
HETATM   45  H   UNL     1       2.958   3.166   2.872  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.939   2.195   0.424  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.686  -3.479   0.488  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.805   3.112  -1.678  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.767   0.905  -2.796  1.00  0.00           H  
CONECT    1   19    8   18                                            
CONECT    2   10    9    9    3                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3   32                                                 
CONECT    5    3    3    6                                            
CONECT    6    8    8    5    7                                       
CONECT    7    6   33   34                                            
CONECT    8    9    1    6    6                                       
CONECT    9    2    2    8   35                                       
CONECT   10   15   11    2   36                                       
CONECT   11   12   10   37   38                                       
CONECT   12   13   14   11   39                                       
CONECT   13   12   40                                                 
CONECT   14   16   12   15   41                                       
CONECT   15   14   10                                                 
CONECT   16   17   14   42   43                                       
CONECT   17   29   16                                                 
CONECT   18    1   44                                                 
CONECT   19    1   45                                                 
CONECT   20   29   29                                                 
CONECT   21   30   46                                                 
CONECT   22   31   31                                                 
CONECT   23   29   47                                                 
CONECT   24   30   30                                                 
CONECT   25   31   48                                                 
CONECT   26   30   29                                                 
CONECT   27   31   30                                                 
CONECT   28   31   49                                                 
CONECT   29   20   20   26   23                                       
CONECT   29   17                                                      
CONECT   30   24   24   27   21                                       
CONECT   30   26                                                      
CONECT   31   22   22   25   28                                       
CONECT   31   27                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
