COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.401  -2.847  -0.248  1.00  0.00           N  
HETATM    2  N   UNL     1       0.765  -1.609  -0.101  1.00  0.00           N  
HETATM    3  C   UNL     1       1.246  -0.329   0.012  1.00  0.00           C  
HETATM    4  C   UNL     1       0.362   0.702   0.147  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.015   0.429   0.167  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.447  -0.816   0.057  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.586  -1.835  -0.077  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.768  -3.204  -0.208  1.00  0.00           C  
HETATM    9  C   UNL     1       0.488  -3.788  -0.311  1.00  0.00           C  
HETATM   10  N   UNL     1       2.604  -0.088  -0.010  1.00  0.00           N  
HETATM   11  C   UNL     1       3.106   1.283   0.111  1.00  0.00           C  
HETATM   12  C   UNL     1       4.612   1.273   0.058  1.00  0.00           C  
HETATM   13  C   UNL     1       5.344   1.142   1.224  1.00  0.00           C  
HETATM   14  C   UNL     1       6.725   1.133   1.175  1.00  0.00           C  
HETATM   15  C   UNL     1       7.375   1.254  -0.039  1.00  0.00           C  
HETATM   16  C   UNL     1       6.643   1.384  -1.204  1.00  0.00           C  
HETATM   17  C   UNL     1       5.262   1.388  -1.157  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.923   1.466   0.303  1.00  0.00           N  
HETATM   19  CA  UNL     1      -3.360   1.183   0.324  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.130   2.422  -0.137  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.741   2.757  -1.578  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.371   3.979  -1.969  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.787   0.818   1.748  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.598   1.945   2.606  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.534   2.163  -0.070  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.090  -3.928  -0.235  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.235  -4.676  -1.562  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.148  -4.926   0.923  1.00  0.00           C  
HETATM   29  H   UNL     1       0.719   1.717   0.237  1.00  0.00           H  
HETATM   30  H   UNL     1       0.682  -4.844  -0.425  1.00  0.00           H  
HETATM   31  H   UNL     1       3.226  -0.826  -0.106  1.00  0.00           H  
HETATM   32  H   UNL     1       2.718   1.886  -0.710  1.00  0.00           H  
HETATM   33  H   UNL     1       2.779   1.708   1.060  1.00  0.00           H  
HETATM   34  H   UNL     1       4.836   1.048   2.172  1.00  0.00           H  
HETATM   35  H   UNL     1       7.297   1.032   2.086  1.00  0.00           H  
HETATM   36  H   UNL     1       8.454   1.248  -0.076  1.00  0.00           H  
HETATM   37  H   UNL     1       7.151   1.479  -2.153  1.00  0.00           H  
HETATM   38  H   UNL     1       4.690   1.486  -2.068  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.607   2.379   0.385  1.00  0.00           H  
HETATM   40  HA  UNL     1      -3.576   0.351  -0.345  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.885   3.264   0.511  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.659   2.868  -1.646  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.067   1.953  -2.238  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.168   4.253  -2.874  1.00  0.00           H  
HETATM   45  H1  UNL     1      -4.839   0.532   1.749  1.00  0.00           H  
HETATM   46  H2  UNL     1      -3.183  -0.016   2.105  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.848   1.785   3.526  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.828   1.440  -0.641  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.901  -3.206  -0.134  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.424  -5.397  -1.663  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.191  -5.199  -1.581  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.194  -3.964  -2.386  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.104  -5.449   0.903  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.337  -5.648   0.822  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.045  -4.393   1.868  1.00  0.00           H  
CONECT    1    9    9    2                                            
CONECT    2    1    3    7                                            
CONECT    3    2   10    4    4                                       
CONECT    4    3    3    5   29                                       
CONECT    5    4    6    6   18                                       
CONECT    6    5    5    7                                            
CONECT    7    2    6    8    8                                       
CONECT    8    7    7    9   26                                       
CONECT    9    1    1    8   30                                       
CONECT   10    3   11   31                                            
CONECT   11   10   12   32   33                                       
CONECT   12   11   13   13   17                                       
CONECT   13   12   12   14   34                                       
CONECT   14   13   15   15   35                                       
CONECT   15   14   14   16   36                                       
CONECT   16   15   17   17   37                                       
CONECT   17   12   16   16   38                                       
CONECT   18    5   19   39                                            
CONECT   19   18   23   20   40                                       
CONECT   20   19   25   21   41                                       
CONECT   21   20   22   42   43                                       
CONECT   22   21   44                                                 
CONECT   23   19   24   45   46                                       
CONECT   24   23   47                                                 
CONECT   25   20   48                                                 
CONECT   26    8   28   27   49                                       
CONECT   27   26   50   51   52                                       
CONECT   28   26   53   54   55                                       
CONECT   29    4                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
