COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.147  -3.622  -0.758  1.00  0.00           C  
HETATM    2  C   UNL     1       2.466  -1.352   0.560  1.00  0.00           C  
HETATM    3  C   UNL     1       1.512  -2.122  -0.115  1.00  0.00           C  
HETATM    4  N   UNL     1       3.487  -4.771  -1.426  1.00  0.00           N  
HETATM    5  N   UNL     1       4.121  -2.912  -0.123  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.984  -1.918  -0.460  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.660  -2.914   0.516  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.158  -2.747   0.164  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.233  -1.370  -0.525  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.195  -0.458   0.240  1.00  0.00           C  
HETATM   11  C   UNL     1       3.815  -1.776   0.542  1.00  0.00           C  
HETATM   12  C   UNL     1       0.549  -0.376   0.823  1.00  0.00           C  
HETATM   13  C   UNL     1       2.439   0.759   1.911  1.00  0.00           C  
HETATM   14  C   UNL     1       2.983   1.827   0.997  1.00  0.00           C  
HETATM   15  C   UNL     1       4.778   2.713  -0.318  1.00  0.00           C  
HETATM   16  C   UNL     1       4.277   1.735   0.521  1.00  0.00           C  
HETATM   17  C   UNL     1       3.983   3.786  -0.682  1.00  0.00           C  
HETATM   18  C   UNL     1       2.184   2.894   0.631  1.00  0.00           C  
HETATM   19  C   UNL     1       2.683   3.875  -0.208  1.00  0.00           C  
HETATM   20  F   UNL     1       4.473   4.745  -1.497  1.00  0.00           F  
HETATM   21  F   UNL     1       1.905   4.922  -0.562  1.00  0.00           F  
HETATM   22  N   UNL     1       1.890  -3.236  -0.753  1.00  0.00           N  
HETATM   23  N   UNL     1       1.815  -0.298   1.110  1.00  0.00           N1+
HETATM   24  N   UNL     1       0.314  -1.484   0.062  1.00  0.00           N  
HETATM   25  O   UNL     1      -1.223  -4.251   0.264  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.583  -3.777  -0.730  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.908  -0.809  -0.510  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.347   0.774  -0.469  1.00  0.00           O  
HETATM   29  O   UNL     1       4.680  -1.134   1.113  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.901   2.346   1.426  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.121   3.245  -0.923  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.826   1.489   0.036  1.00  0.00           O  
HETATM   33  P   UNL     1      -5.290   1.972   0.048  1.00  0.00           P  
HETATM   34  H   UNL     1       4.411  -5.068  -1.442  1.00  0.00           H  
HETATM   35  H   UNL     1       2.805  -5.288  -1.883  1.00  0.00           H  
HETATM   36  H   UNL     1       5.040  -3.223  -0.149  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.869  -2.366  -1.447  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.469  -2.633   1.552  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.764  -2.753   1.071  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.571  -1.489  -1.554  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.164  -0.947   0.331  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.793  -0.258   1.233  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.205   0.330   1.140  1.00  0.00           H  
HETATM   44  H   UNL     1       3.253   0.336   2.500  1.00  0.00           H  
HETATM   45  H   UNL     1       1.696   1.196   2.578  1.00  0.00           H  
HETATM   46  H   UNL     1       5.791   2.642  -0.686  1.00  0.00           H  
HETATM   47  H   UNL     1       4.898   0.898   0.804  1.00  0.00           H  
HETATM   48  H   UNL     1       1.172   2.963   1.000  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.618  -4.911   0.850  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.556  -4.665  -0.348  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.661   4.007  -0.671  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.150   1.228  -0.837  1.00  0.00           H  
CONECT    1   22   22    4    5                                       
CONECT    2   23    3    3   11                                       
CONECT    3   24   22    2    2                                       
CONECT    4    1   34   35                                            
CONECT    5    1   11   36                                            
CONECT    6   27    7   24   37                                       
CONECT    7    8   25    6   38                                       
CONECT    8   26    9    7   39                                       
CONECT    9   10    8   27   40                                       
CONECT   10   28    9   41   42                                       
CONECT   11    2    5   29   29                                       
CONECT   12   24   23   23   43                                       
CONECT   13   23   14   44   45                                       
CONECT   14   16   13   18   18                                       
CONECT   15   16   16   17   46                                       
CONECT   16   15   15   14   47                                       
CONECT   17   15   20   19   19                                       
CONECT   18   14   14   19   48                                       
CONECT   19   17   17   18   21                                       
CONECT   20   17                                                      
CONECT   21   19                                                      
CONECT   22    3    1    1                                            
CONECT   23   12   12   13    2                                       
CONECT   24    6   12    3                                            
CONECT   25    7   49                                                 
CONECT   26    8   50                                                 
CONECT   27    9    6                                                 
CONECT   28   33   10                                                 
CONECT   29   11   11                                                 
CONECT   30   33   33                                                 
CONECT   31   33   51                                                 
CONECT   32   33   52                                                 
CONECT   33   30   30   31   28                                       
CONECT   33   32                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   31                                                      
CONECT   52   32                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
