COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.208  -0.611  -1.026  1.00  0.00           C  
HETATM    2  N   UNL     1       7.077  -0.002  -0.321  1.00  0.00           N  
HETATM    3  N   UNL     1       7.154   1.100   0.537  1.00  0.00           N  
HETATM    4  C   UNL     1       5.972   1.390   1.000  1.00  0.00           C  
HETATM    5  C   UNL     1       5.024   0.437   0.433  1.00  0.00           C  
HETATM    6  C   UNL     1       3.643   0.250   0.558  1.00  0.00           C  
HETATM    7  C   UNL     1       3.031  -0.777  -0.134  1.00  0.00           C  
HETATM    8  N   UNL     1       1.649  -0.971  -0.015  1.00  0.00           N  
HETATM    9  C   UNL     1       0.811   0.116   0.171  1.00  0.00           C  
HETATM   10  N   UNL     1       1.319   1.339   0.129  1.00  0.00           N  
HETATM   11  C   UNL     1       0.549   2.403   0.302  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.802   2.230   0.530  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.309   0.929   0.569  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.480  -0.093   0.381  1.00  0.00           N  
HETATM   15  N   UNL     1      -2.660   0.707   0.789  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.582   1.841   0.885  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.125   2.176  -0.506  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.089   3.361  -0.406  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.596   3.674  -1.704  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.141  -0.596   0.918  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.203  -1.194   2.162  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.686  -2.488   2.298  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.111  -3.198   1.198  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.060  -2.618  -0.068  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.400  -3.054  -1.323  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.124  -2.024  -2.230  1.00  0.00           N  
HETATM   27  C   UNL     1      -3.639  -0.997  -1.594  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.572  -1.308  -0.216  1.00  0.00           C  
HETATM   29  C   UNL     1       3.783  -1.622  -0.951  1.00  0.00           C  
HETATM   30  C   UNL     1       5.131  -1.450  -1.081  1.00  0.00           C  
HETATM   31  C   UNL     1       5.772  -0.418  -0.399  1.00  0.00           C  
HETATM   32  H   UNL     1       8.334  -0.128  -1.995  1.00  0.00           H  
HETATM   33  H   UNL     1       9.115  -0.484  -0.436  1.00  0.00           H  
HETATM   34  H   UNL     1       8.015  -1.674  -1.172  1.00  0.00           H  
HETATM   35  H   UNL     1       5.735   2.193   1.682  1.00  0.00           H  
HETATM   36  H   UNL     1       3.060   0.903   1.190  1.00  0.00           H  
HETATM   37  H   UNL     1       1.279  -1.866  -0.063  1.00  0.00           H  
HETATM   38  H   UNL     1       0.974   3.395   0.266  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.451   3.080   0.674  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.410   1.582   1.545  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.054   2.706   1.286  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.298   2.436  -1.166  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.654   1.312  -0.908  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.916   3.102   0.255  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.560   4.226  -0.004  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.214   4.417  -1.717  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.872  -0.650   3.035  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.728  -2.943   3.277  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.485  -4.204   1.317  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.767  -3.924  -1.544  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.339  -0.062  -2.045  1.00  0.00           H  
HETATM   52  H   UNL     1       3.293  -2.422  -1.487  1.00  0.00           H  
HETATM   53  H   UNL     1       5.700  -2.111  -1.717  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    3    1   31                                            
CONECT    3    4    4    2                                            
CONECT    4    3    3    5   35                                       
CONECT    5    4   31   31    6                                       
CONECT    6    5    7    7   36                                       
CONECT    7    6    6   29    8                                       
CONECT    8    7    9   37                                            
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11                                            
CONECT   11   12   12   10   38                                       
CONECT   12   13   11   11   39                                       
CONECT   13   15   14   14   12                                       
CONECT   14   13   13    9                                            
CONECT   15   16   20   13                                            
CONECT   16   17   15   40   41                                       
CONECT   17   18   16   42   43                                       
CONECT   18   19   17   44   45                                       
CONECT   19   18   46                                                 
CONECT   20   21   21   28   15                                       
CONECT   21   22   20   20   47                                       
CONECT   22   23   23   21   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24   23   25   28   28                                       
CONECT   25   24   26   50                                            
CONECT   26   25   27   27                                            
CONECT   27   28   26   26   51                                       
CONECT   28   24   24   20   27                                       
CONECT   29   30   30    7   52                                       
CONECT   30   31   29   29   53                                       
CONECT   31    2    5    5   30                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
