COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.590  -1.999   0.135  1.00  0.00           C  
HETATM    2  C   UNL     1       2.384  -0.487   0.256  1.00  0.00           C  
HETATM    3  C   UNL     1       4.519  -0.773  -0.065  1.00  0.00           C  
HETATM    4  C   UNL     1       5.815  -1.243  -0.290  1.00  0.00           C  
HETATM    5  C   UNL     1       6.872  -0.360  -0.303  1.00  0.00           C  
HETATM    6  C   UNL     1       4.311   0.601   0.157  1.00  0.00           C  
HETATM    7  C   UNL     1       0.386   3.509  -0.068  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.034   3.370  -0.622  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.867   2.498   0.322  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.721   1.074  -0.173  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.004   1.763   0.113  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.452  -0.564   0.191  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.104  -0.258  -0.015  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.776  -3.655  -0.206  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.759  -1.135   0.067  1.00  0.00           C  
HETATM   16  O   UNL     1       1.370  -2.919  -0.008  1.00  0.00           O  
HETATM   17  N   UNL     1       1.015  -0.723   0.397  1.00  0.00           N  
HETATM   18  N   UNL     1       3.301  -1.376  -0.001  1.00  0.00           N  
HETATM   19  C   UNL     1       6.661   0.993  -0.090  1.00  0.00           C  
HETATM   20  C   UNL     1       5.389   1.473   0.140  1.00  0.00           C  
HETATM   21  N   UNL     1       2.951   0.753   0.364  1.00  0.00           N  
HETATM   22  C   UNL     1       2.242   2.001   0.652  1.00  0.00           C  
HETATM   23  C   UNL     1       1.199   2.266  -0.436  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.428   1.410  -0.410  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.677   2.079  -0.103  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.392   0.442   0.255  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.123  -1.370  -0.036  1.00  0.00           C  
HETATM   28  N   UNL     1      -3.579  -2.613  -0.165  1.00  0.00           N  
HETATM   29  C   UNL     1      -1.405  -3.503  -0.117  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.874  -2.217   0.026  1.00  0.00           C  
HETATM   31  H   UNL     1       5.988  -2.296  -0.453  1.00  0.00           H  
HETATM   32  H   UNL     1       7.873  -0.726  -0.479  1.00  0.00           H  
HETATM   33  H   UNL     1       0.859   4.392  -0.497  1.00  0.00           H  
HETATM   34  H   UNL     1       0.346   3.608   1.017  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.492   4.356  -0.702  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.999   2.905  -1.607  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.224   2.110   1.114  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.659   3.099   0.766  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.743   2.548   0.169  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.754  -1.595   0.303  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.194  -4.645  -0.312  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.369  -0.136   0.187  1.00  0.00           H  
HETATM   43  H   UNL     1       0.401  -0.022   0.682  1.00  0.00           H  
HETATM   44  H   UNL     1       7.498   1.676  -0.104  1.00  0.00           H  
HETATM   45  H   UNL     1       5.231   2.528   0.307  1.00  0.00           H  
HETATM   46  H   UNL     1       1.747   1.923   1.620  1.00  0.00           H  
HETATM   47  H   UNL     1       2.955   2.827   0.678  1.00  0.00           H  
HETATM   48  H   UNL     1       0.532   1.410  -0.523  1.00  0.00           H  
HETATM   49  H   UNL     1       1.701   2.431  -1.389  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.383   3.111  -0.219  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.432   0.200   0.414  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.756  -4.365  -0.159  1.00  0.00           H  
CONECT    1   17   30   16   16                                       
CONECT    2   21   17   18   18                                       
CONECT    3    6   18    4    4                                       
CONECT    4    3    3    5   31                                       
CONECT    5   19   19    4   32                                       
CONECT    6   20   20   21    3                                       
CONECT    7    8   23   33   34                                       
CONECT    8    9    7   35   36                                       
CONECT    9    8   24   37   38                                       
CONECT   10   25   24   13   13                                       
CONECT   11   25   25   26   39                                       
CONECT   12   26   26   13   40                                       
CONECT   13   10   10   12   27                                       
CONECT   14   28   28   29   41                                       
CONECT   15   27   27   30   42                                       
CONECT   16    1    1                                                 
CONECT   17    2    1   43                                            
CONECT   18    2    2    3                                            
CONECT   19   20    5    5   44                                       
CONECT   20    6    6   19   45                                       
CONECT   21   22    6    2                                            
CONECT   22   23   21   46   47                                       
CONECT   23    7   22   48   49                                       
CONECT   24    9   10                                                 
CONECT   25   11   11   10   50                                       
CONECT   26   11   12   12   51                                       
CONECT   27   13   15   15   28                                       
CONECT   28   27   14   14                                            
CONECT   29   14   30   30   52                                       
CONECT   30   15   29   29    1                                       
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
