COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.401  -2.304  -0.652  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.765  -1.093  -0.346  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.471  -1.074   0.091  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.734  -3.502  -0.518  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.407  -3.507  -0.072  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.771  -2.278   0.235  1.00  0.00           C  
HETATM    7  C   UNL     1       0.571  -2.315   0.684  1.00  0.00           C  
HETATM    8  N   UNL     1       1.163  -3.497   0.794  1.00  0.00           N  
HETATM    9  C   UNL     1       0.529  -4.620   0.495  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.714  -4.646   0.075  1.00  0.00           N  
HETATM   11  O   UNL     1      -4.690  -2.297  -1.079  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.444   0.077  -0.486  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.285  -3.563  -1.370  1.00  0.00           C  
HETATM   14  N   UNL     1       1.244  -1.153   0.999  1.00  0.00           N  
HETATM   15  C   UNL     1       1.637  -1.140   2.414  1.00  0.00           C  
HETATM   16  C   UNL     1       2.250   0.219   2.761  1.00  0.00           C  
HETATM   17  C   UNL     1       3.471   0.465   1.871  1.00  0.00           C  
HETATM   18  C   UNL     1       3.044   0.398   0.402  1.00  0.00           C  
HETATM   19  C   UNL     1       2.408  -0.966   0.123  1.00  0.00           C  
HETATM   20  C   UNL     1       4.250   0.581  -0.482  1.00  0.00           C  
HETATM   21  C   UNL     1       5.305  -0.310  -0.405  1.00  0.00           C  
HETATM   22  C   UNL     1       6.412  -0.141  -1.216  1.00  0.00           C  
HETATM   23  C   UNL     1       6.464   0.917  -2.103  1.00  0.00           C  
HETATM   24  C   UNL     1       5.410   1.807  -2.181  1.00  0.00           C  
HETATM   25  C   UNL     1       4.300   1.636  -1.374  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.742   1.278  -0.158  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.661   2.482  -0.376  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.920   3.748  -0.030  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.366   3.875   1.160  1.00  0.00           N  
HETATM   30  C   UNL     1      -1.709   4.964   1.506  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.576   6.020   0.624  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.146   5.923  -0.636  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.825   4.760  -0.966  1.00  0.00           C  
HETATM   34  H   UNL     1      -0.990  -0.136   0.324  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.231  -4.431  -0.756  1.00  0.00           H  
HETATM   36  H   UNL     1       1.058  -5.555   0.601  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.718  -4.059  -2.158  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.277  -4.182  -0.472  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.313  -3.415  -1.700  1.00  0.00           H  
HETATM   40  H   UNL     1       0.759  -1.312   3.036  1.00  0.00           H  
HETATM   41  H   UNL     1       2.371  -1.926   2.595  1.00  0.00           H  
HETATM   42  H   UNL     1       1.513   1.004   2.594  1.00  0.00           H  
HETATM   43  H   UNL     1       2.555   0.223   3.808  1.00  0.00           H  
HETATM   44  H   UNL     1       3.885   1.451   2.085  1.00  0.00           H  
HETATM   45  H   UNL     1       4.225  -0.297   2.067  1.00  0.00           H  
HETATM   46  H   UNL     1       2.319   1.186   0.198  1.00  0.00           H  
HETATM   47  H   UNL     1       3.138  -1.753   0.315  1.00  0.00           H  
HETATM   48  H   UNL     1       2.090  -1.012  -0.918  1.00  0.00           H  
HETATM   49  H   UNL     1       5.264  -1.136   0.289  1.00  0.00           H  
HETATM   50  H   UNL     1       7.236  -0.837  -1.155  1.00  0.00           H  
HETATM   51  H   UNL     1       7.330   1.049  -2.736  1.00  0.00           H  
HETATM   52  H   UNL     1       5.451   2.634  -2.874  1.00  0.00           H  
HETATM   53  H   UNL     1       3.474   2.329  -1.437  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.430   1.243   0.886  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.863   1.371  -0.796  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.972   2.516  -1.420  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.539   2.389   0.262  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.268   5.032   2.490  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.037   6.910   0.913  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.059   6.733  -1.346  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.281   4.650  -1.939  1.00  0.00           H  
CONECT    1    2    2   11    4                                       
CONECT    2    1    1   12    3                                       
CONECT    3    2    6    6   34                                       
CONECT    4    1    5    5   35                                       
CONECT    5    4    4    6   10                                       
CONECT    6    3    3    5    7                                       
CONECT    7    6   14    8    8                                       
CONECT    8    7    7    9                                            
CONECT    9    8   10   10   36                                       
CONECT   10    5    9    9                                            
CONECT   11    1   13                                                 
CONECT   12    2   26                                                 
CONECT   13   11   37   38   39                                       
CONECT   14    7   19   15                                            
CONECT   15   14   16   40   41                                       
CONECT   16   15   17   42   43                                       
CONECT   17   16   18   44   45                                       
CONECT   18   17   20   19   46                                       
CONECT   19   14   18   47   48                                       
CONECT   20   18   21   21   25                                       
CONECT   21   20   20   22   49                                       
CONECT   22   21   23   23   50                                       
CONECT   23   22   22   24   51                                       
CONECT   24   23   25   25   52                                       
CONECT   25   20   24   24   53                                       
CONECT   26   12   27   54   55                                       
CONECT   27   26   28   56   57                                       
CONECT   28   27   33   33   29                                       
CONECT   29   28   30   30                                            
CONECT   30   29   29   31   58                                       
CONECT   31   30   32   32   59                                       
CONECT   32   31   31   33   60                                       
CONECT   33   28   28   32   61                                       
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
