COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.238  -6.317   1.655  1.00  0.00           C  
HETATM    2  N   UNL     1       1.860  -5.808   0.465  1.00  0.00           N  
HETATM    3  C   UNL     1       1.264  -4.612   0.618  1.00  0.00           C  
HETATM    4  C   UNL     1       1.042  -3.945   1.819  1.00  0.00           C  
HETATM    5  C   UNL     1       1.479  -4.572   2.995  1.00  0.00           C  
HETATM    6  N   UNL     1       2.088  -5.785   2.889  1.00  0.00           N  
HETATM    7  O   UNL     1       0.781  -3.870  -0.420  1.00  0.00           O  
HETATM    8  C   UNL     1       0.255  -2.737   0.115  1.00  0.00           C  
HETATM    9  C   UNL     1       0.390  -2.734   1.485  1.00  0.00           C  
HETATM   10  N   UNL     1       1.301  -3.987   4.242  1.00  0.00           N  
HETATM   11  C   UNL     1       1.729  -4.586   5.477  1.00  0.00           C  
HETATM   12  C   UNL     1       1.379  -3.724   6.679  1.00  0.00           C  
HETATM   13  N   UNL     1       1.831  -4.320   7.935  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.072  -1.663   2.321  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.368  -1.689   2.837  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.816  -0.648   3.651  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.969   0.419   3.948  1.00  0.00           C  
HETATM   18  C   UNL     1       0.327   0.446   3.433  1.00  0.00           C  
HETATM   19  C   UNL     1       0.775  -0.595   2.619  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.305  -1.825  -0.846  1.00  0.00           C  
HETATM   21  C   UNL     1       0.493  -0.834  -1.422  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.051   0.050  -2.354  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.395  -0.056  -2.714  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.195  -1.045  -2.140  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.651  -1.928  -1.208  1.00  0.00           C  
HETATM   26  C   UNL     1       1.535  -3.435   9.069  1.00  0.00           C  
HETATM   27  C   UNL     1       1.219  -5.640   8.137  1.00  0.00           C  
HETATM   28  C   UNL     1       1.999  -4.065  10.384  1.00  0.00           C  
HETATM   29  C   UNL     1       1.685  -6.257   9.457  1.00  0.00           C  
HETATM   30  N   UNL     1       1.396  -5.383  10.596  1.00  0.00           N  
HETATM   31  H   UNL     1       2.729  -7.283   1.617  1.00  0.00           H  
HETATM   32  H   UNL     1       0.840  -3.082   4.278  1.00  0.00           H  
HETATM   33  H   UNL     1       2.813  -4.720   5.411  1.00  0.00           H  
HETATM   34  H   UNL     1       1.261  -5.573   5.544  1.00  0.00           H  
HETATM   35  H   UNL     1       0.298  -3.572   6.760  1.00  0.00           H  
HETATM   36  H   UNL     1       1.863  -2.747   6.595  1.00  0.00           H  
HETATM   37  H   UNL     1       1.788  -0.560   2.225  1.00  0.00           H  
HETATM   38  H   UNL     1       0.987   1.276   3.666  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.318   1.229   4.581  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.825  -0.669   4.051  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.041  -2.513   2.613  1.00  0.00           H  
HETATM   42  H   UNL     1       1.542  -0.739  -1.152  1.00  0.00           H  
HETATM   43  H   UNL     1       0.572   0.820  -2.799  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.819   0.632  -3.439  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.241  -1.127  -2.421  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.288  -2.694  -0.771  1.00  0.00           H  
HETATM   47  H   UNL     1       0.459  -3.218   9.121  1.00  0.00           H  
HETATM   48  H   UNL     1       2.056  -2.479   8.935  1.00  0.00           H  
HETATM   49  H   UNL     1       1.508  -6.308   7.317  1.00  0.00           H  
HETATM   50  H   UNL     1       3.094  -4.148  10.399  1.00  0.00           H  
HETATM   51  H   UNL     1       1.717  -3.410  11.216  1.00  0.00           H  
HETATM   52  H   UNL     1       1.172  -7.213   9.608  1.00  0.00           H  
HETATM   53  H   UNL     1       1.772  -5.797  11.448  1.00  0.00           H  
HETATM   54  H   UNL     1       0.123  -5.565   8.128  1.00  0.00           H  
HETATM   55  H   UNL     1       2.760  -6.474   9.417  1.00  0.00           H  
CONECT    1    6    6    2   31                                       
CONECT    2    1    3    3                                            
CONECT    3    2    2    4    7                                       
CONECT    4    3    5    5    9                                       
CONECT    5    4    4    6   10                                       
CONECT    6    1    1    5                                            
CONECT    7    3    8                                                 
CONECT    8    7    9    9   20                                       
CONECT    9    4    8    8   14                                       
CONECT   10    5   11   32                                            
CONECT   11   10   12   33   34                                       
CONECT   12   11   13   35   36                                       
CONECT   13   12   27   26                                            
CONECT   14    9   19   19   15                                       
CONECT   15   14   16   16   41                                       
CONECT   16   15   15   17   40                                       
CONECT   17   16   18   18   39                                       
CONECT   18   17   17   19   38                                       
CONECT   19   14   14   18   37                                       
CONECT   20    8   21   21   25                                       
CONECT   21   20   20   22   42                                       
CONECT   22   21   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   23   25   25   45                                       
CONECT   25   20   24   24   46                                       
CONECT   26   13   28   47   48                                       
CONECT   27   13   29   49   54                                       
CONECT   28   26   30   50   51                                       
CONECT   29   27   30   52   55                                       
CONECT   30   28   29   53                                            
CONECT   31    1                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   19                                                      
CONECT   38   18                                                      
CONECT   39   17                                                      
CONECT   40   16                                                      
CONECT   41   15                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   27                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
