COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.832   2.803  -0.750  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.382  -2.523  -0.163  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.564  -2.056   0.185  1.00  0.00           N  
HETATM    4  C   UNL     1      -3.966  -0.890   0.189  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.536  -1.128  -0.040  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.616   0.428   0.380  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.099   1.334   1.306  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.742   0.767  -0.370  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.299  -0.207  -1.375  1.00  0.00           C  
HETATM   10  C   UNL     1       8.228  -1.287   1.789  1.00  0.00           C  
HETATM   11  C   UNL     1       6.923  -0.832   1.188  1.00  0.00           C  
HETATM   12  C   UNL     1       5.696   0.627  -0.236  1.00  0.00           C  
HETATM   13  C   UNL     1       4.571  -0.186  -0.222  1.00  0.00           C  
HETATM   14  C   UNL     1       3.366   0.294  -0.715  1.00  0.00           C  
HETATM   15  C   UNL     1       3.290   1.585  -1.223  1.00  0.00           C  
HETATM   16  C   UNL     1       4.412   2.391  -1.235  1.00  0.00           C  
HETATM   17  C   UNL     1       5.612   1.918  -0.739  1.00  0.00           C  
HETATM   18  C   UNL     1       1.015   0.018  -0.484  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.170  -0.854  -0.371  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.031  -2.244  -0.492  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.115  -3.062  -0.390  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.423  -0.295  -0.145  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.705   2.560   1.482  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.831   2.893   0.737  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.344   1.994  -0.191  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.933  -4.504  -0.089  1.00  0.00           C  
HETATM   27  N   UNL     1       6.913   0.147   0.261  1.00  0.00           N  
HETATM   28  N   UNL     1       2.231  -0.522  -0.703  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.628  -3.073  -0.023  1.00  0.00           N  
HETATM   30  N   UNL     1      -6.443   4.135   0.917  1.00  0.00           N  
HETATM   31  O   UNL     1       5.882  -1.346   1.539  1.00  0.00           O  
HETATM   32  O   UNL     1       0.896   1.224  -0.379  1.00  0.00           O  
HETATM   33  H   UNL     1       7.370   2.668  -1.688  1.00  0.00           H  
HETATM   34  H   UNL     1       6.526   3.845  -0.654  1.00  0.00           H  
HETATM   35  H   UNL     1       7.481   2.537   0.084  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.225   1.076   1.885  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.039  -0.845  -0.892  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.771   0.342  -2.191  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.492  -0.823  -1.771  1.00  0.00           H  
HETATM   40  H   UNL     1       8.639  -2.100   1.190  1.00  0.00           H  
HETATM   41  H   UNL     1       8.932  -0.455   1.803  1.00  0.00           H  
HETATM   42  H   UNL     1       8.057  -1.636   2.807  1.00  0.00           H  
HETATM   43  H   UNL     1       4.633  -1.189   0.173  1.00  0.00           H  
HETATM   44  H   UNL     1       2.353   1.959  -1.607  1.00  0.00           H  
HETATM   45  H   UNL     1       4.350   3.395  -1.630  1.00  0.00           H  
HETATM   46  H   UNL     1       0.945  -2.671  -0.669  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.995  -4.131  -0.485  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.534   0.775  -0.052  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.306   3.262   2.199  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.216   2.257  -0.772  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.152  -4.782  -1.120  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.076  -5.075   0.268  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.799  -4.720   0.537  1.00  0.00           H  
HETATM   54  H   UNL     1       7.749   0.518  -0.061  1.00  0.00           H  
HETATM   55  H   UNL     1       2.317  -1.476  -0.853  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.083   4.764   1.561  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.228   4.368   0.398  1.00  0.00           H  
CONECT    1   17   33   34   35                                       
CONECT    2   29    5    5   21                                       
CONECT    3   29    4    4                                            
CONECT    4    3    3    6    5                                       
CONECT    5    4    2    2   22                                       
CONECT    6    8    4    7    7                                       
CONECT    7    6    6   23   36                                       
CONECT    8    9   25   25    6                                       
CONECT    9    8   37   38   39                                       
CONECT   10   11   40   41   42                                       
CONECT   11   27   10   31   31                                       
CONECT   12   13   27   17   17                                       
CONECT   13   14   14   12   43                                       
CONECT   14   28   13   13   15                                       
CONECT   15   14   16   16   44                                       
CONECT   16   15   15   17   45                                       
CONECT   17   12   12   16    1                                       
CONECT   18   19   28   32   32                                       
CONECT   19   22   22   20   18                                       
CONECT   20   21   21   19   46                                       
CONECT   21    2   20   20   47                                       
CONECT   22    5   19   19   48                                       
CONECT   23   24   24    7   49                                       
CONECT   24   25   30   23   23                                       
CONECT   25    8    8   24   50                                       
CONECT   26   29   51   52   53                                       
CONECT   27   12   11   54                                            
CONECT   28   18   14   55                                            
CONECT   29   26    3    2                                            
CONECT   30   24   56   57                                            
CONECT   31   11   11                                                 
CONECT   32   18   18                                                 
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
