COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.433  -1.051  -0.829  1.00  0.00           C  
HETATM    2  C   UNL     1       6.010  -0.688  -0.492  1.00  0.00           C  
HETATM    3  C   UNL     1       4.891  -1.337  -0.893  1.00  0.00           C  
HETATM    4  N   UNL     1       5.603   0.335   0.268  1.00  0.00           N  
HETATM    5  N   UNL     1       4.318   0.324   0.329  1.00  0.00           N  
HETATM    6  N   UNL     1       3.850  -0.665  -0.349  1.00  0.00           N  
HETATM    7  C   UNL     1       2.434  -1.002  -0.509  1.00  0.00           C  
HETATM    8  C   UNL     1       1.789  -1.164   0.869  1.00  0.00           C  
HETATM    9  N   UNL     1       0.405  -1.618   0.711  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.032  -2.893   0.788  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.322  -2.924   0.597  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.778  -1.676   0.388  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.186  -1.287   0.132  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.108  -2.010  -0.569  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.818  -0.108   0.574  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.054  -0.126   0.151  1.00  0.00           N  
HETATM   17  N   UNL     1      -5.261  -1.309  -0.569  1.00  0.00           N  
HETATM   18  C   UNL     1      -6.514  -1.717  -1.208  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.692  -0.822   0.462  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.706   0.643   0.303  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.264   1.217  -0.844  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.277   2.575  -0.992  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.731   3.391   0.005  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.744   4.815  -0.150  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.754   5.944  -0.273  1.00  0.00           N  
HETATM   26  C   UNL     1      -0.173   2.817   1.152  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.165   1.460   1.302  1.00  0.00           C  
HETATM   28  H   UNL     1       7.820  -1.739  -0.078  1.00  0.00           H  
HETATM   29  H   UNL     1       7.464  -1.528  -1.809  1.00  0.00           H  
HETATM   30  H   UNL     1       8.044  -0.149  -0.845  1.00  0.00           H  
HETATM   31  H   UNL     1       4.840  -2.214  -1.521  1.00  0.00           H  
HETATM   32  H   UNL     1       1.930  -0.204  -1.054  1.00  0.00           H  
HETATM   33  H   UNL     1       2.343  -1.935  -1.065  1.00  0.00           H  
HETATM   34  H   UNL     1       2.349  -1.900   1.448  1.00  0.00           H  
HETATM   35  H   UNL     1       1.800  -0.207   1.390  1.00  0.00           H  
HETATM   36  H   UNL     1       0.590  -3.755   0.978  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.945  -2.968  -1.039  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.360   0.676   1.160  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.113  -2.291  -0.501  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.069  -0.831  -1.518  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.294  -2.332  -2.081  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.685   0.587  -1.614  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.707   3.018  -1.877  1.00  0.00           H  
HETATM   44  H   UNL     1       0.248   3.448   1.921  1.00  0.00           H  
HETATM   45  H   UNL     1       0.266   1.017   2.188  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    3    4    1                                       
CONECT    3    6    2    2   31                                       
CONECT    4    5    5    2                                            
CONECT    5    6    4    4                                            
CONECT    6    7    3    5                                            
CONECT    7    8    6   32   33                                       
CONECT    8    9    7   34   35                                       
CONECT    9   10    8   19                                            
CONECT   10   11   11    9   36                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   19   19                                       
CONECT   13   14   14   15   12                                       
CONECT   14   17   13   13   37                                       
CONECT   15   16   16   13   38                                       
CONECT   16   17   15   15                                            
CONECT   17   18   14   16                                            
CONECT   18   17   39   40   41                                       
CONECT   19   12   12    9   20                                       
CONECT   20   27   19   21   21                                       
CONECT   21   20   20   22   42                                       
CONECT   22   23   23   21   43                                       
CONECT   23   26   24   22   22                                       
CONECT   24   23   25   25   25                                       
CONECT   25   24   24   24                                            
CONECT   26   27   27   23   44                                       
CONECT   27   26   26   20   45                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
