COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.040   0.084  -0.065  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.579  -0.175  -0.032  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.680   0.899  -0.005  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.174   3.222   0.020  1.00  0.00           C  
HETATM    5  N   UNL     1       2.017   0.653   0.105  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.848   0.227  -1.157  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.321   0.661   0.026  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.844  -0.650   0.030  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.742  -1.729   0.002  1.00  0.00           C  
HETATM   10  O   UNL     1      -7.084   0.441  -0.684  1.00  0.00           O  
HETATM   11  N   UNL     1       5.070   2.530   0.186  1.00  0.00           N  
HETATM   12  C   UNL     1       0.337  -2.631   0.046  1.00  0.00           C  
HETATM   13  N   UNL     1       3.671   2.465   0.154  1.00  0.00           N  
HETATM   14  C   UNL     1      -5.580   0.167   2.499  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.931   0.236   1.035  1.00  0.00           C  
HETATM   16  N   UNL     1      -7.109   0.442   0.524  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.433   0.159  -2.604  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.109  -1.482  -0.023  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.008  -2.906   0.013  1.00  0.00           N  
HETATM   20  N   UNL     1       1.424  -3.401   0.067  1.00  0.00           N  
HETATM   21  C   UNL     1       2.627  -2.869   0.098  1.00  0.00           C  
HETATM   22  C   UNL     1       3.824  -3.785   0.120  1.00  0.00           C  
HETATM   23  N   UNL     1       2.828  -1.565   0.110  1.00  0.00           N  
HETATM   24  C   UNL     1       1.803  -0.715   0.092  1.00  0.00           C  
HETATM   25  C   UNL     1       0.504  -1.237   0.058  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.147   2.176  -0.009  1.00  0.00           O  
HETATM   27  C   UNL     1       3.317   1.155   0.138  1.00  0.00           C  
HETATM   28  C   UNL     1       2.755   3.608   0.141  1.00  0.00           C  
HETATM   29  C   UNL     1       5.541   1.309   0.189  1.00  0.00           C  
HETATM   30  C   UNL     1       4.463   0.420   0.159  1.00  0.00           C  
HETATM   31  C   UNL     1       6.998   0.927   0.219  1.00  0.00           C  
HETATM   32  C   UNL     1       7.681   0.640  -1.120  1.00  0.00           C  
HETATM   33  C   UNL     1       7.359  -0.510  -0.162  1.00  0.00           C  
HETATM   34  H   UNL     1      -1.571   3.133   0.924  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.529   3.143  -0.855  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.678   4.188   0.013  1.00  0.00           H  
HETATM   37  H   UNL     1       1.262   1.262   0.092  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.628   1.489   0.047  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.316   1.162   2.857  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.437  -0.206   3.060  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.734  -0.506   2.638  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.508  -0.871  -2.956  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.087   0.795  -3.201  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.403   0.502  -2.704  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.805  -2.307  -0.041  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.391  -3.797  -0.001  1.00  0.00           H  
HETATM   47  H   UNL     1       4.136  -4.000  -0.902  1.00  0.00           H  
HETATM   48  H   UNL     1       4.641  -3.303   0.655  1.00  0.00           H  
HETATM   49  H   UNL     1       3.559  -4.716   0.622  1.00  0.00           H  
HETATM   50  H   UNL     1       2.550   3.898  -0.890  1.00  0.00           H  
HETATM   51  H   UNL     1       1.822   3.331   0.632  1.00  0.00           H  
HETATM   52  H   UNL     1       3.210   4.445   0.670  1.00  0.00           H  
HETATM   53  H   UNL     1       4.528  -0.658   0.154  1.00  0.00           H  
HETATM   54  H   UNL     1       7.594   1.406   0.996  1.00  0.00           H  
HETATM   55  H   UNL     1       7.076   0.728  -2.022  1.00  0.00           H  
HETATM   56  H   UNL     1       8.726   0.931  -1.224  1.00  0.00           H  
HETATM   57  H   UNL     1       8.193  -0.976   0.363  1.00  0.00           H  
HETATM   58  H   UNL     1       6.543  -1.179  -0.435  1.00  0.00           H  
CONECT    1    6    6   15    2                                       
CONECT    2    1   18   18    3                                       
CONECT    3    2   26    7    7                                       
CONECT    4   26   34   35   36                                       
CONECT    5   27   24   37                                            
CONECT    6   17   10    1    1                                       
CONECT    7    3    3    8   38                                       
CONECT    8    9    9    7   25                                       
CONECT    9   18   19    8    8                                       
CONECT   10    6   16                                                 
CONECT   11   29   29   13                                            
CONECT   12   19   25   25   20                                       
CONECT   13   11   27   28                                            
CONECT   14   15   39   40   41                                       
CONECT   15   16   16    1   14                                       
CONECT   16   10   15   15                                            
CONECT   17    6   42   43   44                                       
CONECT   18    2    2    9   45                                       
CONECT   19    9   12   46                                            
CONECT   20   12   21   21                                            
CONECT   21   20   20   23   22                                       
CONECT   22   21   47   48   49                                       
CONECT   23   24   24   21                                            
CONECT   24   25    5   23   23                                       
CONECT   25    8   12   12   24                                       
CONECT   26    3    4                                                 
CONECT   27   30   30   13    5                                       
CONECT   28   13   50   51   52                                       
CONECT   29   31   30   11   11                                       
CONECT   30   29   27   27   53                                       
CONECT   31   33   32   29   54                                       
CONECT   32   33   31   55   56                                       
CONECT   33   32   31   57   58                                       
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
