COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.632   5.274  -1.120  1.00  0.00           C  
HETATM    2  N   UNL     1       2.334   4.024  -0.798  1.00  0.00           N  
HETATM    3  C   UNL     1       3.778   4.155  -1.034  1.00  0.00           C  
HETATM    4  C   UNL     1       2.062   3.608   0.584  1.00  0.00           C  
HETATM    5  C   UNL     1       2.798   2.335   0.858  1.00  0.00           C  
HETATM    6  C   UNL     1       2.202   1.152   0.908  1.00  0.00           C  
HETATM    7  C   UNL     1       0.744   1.066   0.698  1.00  0.00           C  
HETATM    8  C   UNL     1       0.133  -0.141   0.405  1.00  0.00           C  
HETATM    9  C   UNL     1       0.943  -1.371   0.295  1.00  0.00           C  
HETATM   10  C   UNL     1       0.762  -2.412   1.210  1.00  0.00           C  
HETATM   11  C   UNL     1       1.520  -3.558   1.105  1.00  0.00           C  
HETATM   12  C   UNL     1       2.462  -3.679   0.091  1.00  0.00           C  
HETATM   13  O   UNL     1       3.207  -4.811  -0.010  1.00  0.00           O  
HETATM   14  C   UNL     1       4.157  -4.870  -1.076  1.00  0.00           C  
HETATM   15  C   UNL     1       2.644  -2.647  -0.821  1.00  0.00           C  
HETATM   16  C   UNL     1       1.887  -1.500  -0.726  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.327  -0.199   0.200  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.847  -0.540  -1.052  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.210  -0.594  -1.239  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.070  -0.307  -0.183  1.00  0.00           C  
HETATM   21  N   UNL     1      -5.450  -0.362  -0.376  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.994  -0.596  -1.716  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.356  -0.184   0.761  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.557   0.033   1.064  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.194   0.083   1.260  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.040   2.310   0.814  1.00  0.00           C  
HETATM   27  C   UNL     1       0.582   3.479   0.766  1.00  0.00           C  
HETATM   28  H   UNL     1       1.851   5.558  -2.149  1.00  0.00           H  
HETATM   29  H   UNL     1       0.558   5.128  -1.004  1.00  0.00           H  
HETATM   30  H   UNL     1       1.967   6.062  -0.446  1.00  0.00           H  
HETATM   31  H   UNL     1       4.178   4.952  -0.407  1.00  0.00           H  
HETATM   32  H   UNL     1       4.273   3.216  -0.788  1.00  0.00           H  
HETATM   33  H   UNL     1       3.955   4.395  -2.082  1.00  0.00           H  
HETATM   34  H   UNL     1       2.431   4.379   1.261  1.00  0.00           H  
HETATM   35  H   UNL     1       3.864   2.382   1.023  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.005   4.380   0.863  1.00  0.00           H  
HETATM   37  H   UNL     1       2.779   0.259   1.099  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.113   2.268   0.936  1.00  0.00           H  
HETATM   39  H   UNL     1       0.031  -2.319   1.999  1.00  0.00           H  
HETATM   40  H   UNL     1       2.026  -0.700  -1.438  1.00  0.00           H  
HETATM   41  H   UNL     1       1.382  -4.363   1.811  1.00  0.00           H  
HETATM   42  H   UNL     1       3.378  -2.746  -1.608  1.00  0.00           H  
HETATM   43  H   UNL     1       4.683  -5.824  -1.041  1.00  0.00           H  
HETATM   44  H   UNL     1       3.639  -4.774  -2.030  1.00  0.00           H  
HETATM   45  H   UNL     1       4.874  -4.056  -0.969  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.179  -0.762  -1.872  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.797   0.343   2.230  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.612  -0.858  -2.206  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.227   0.255   1.881  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.112  -1.668  -1.878  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.963  -0.106  -1.806  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.310  -0.190  -2.462  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.778   0.067   1.650  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.058   0.621   0.544  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.907  -1.109   0.935  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    1    3    4                                            
CONECT    3    2   31   32   33                                       
CONECT    4    2    5   27   34                                       
CONECT    5    4    6    6   35                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   26                                       
CONECT    8    7    7    9   17                                       
CONECT    9    8   10   16   16                                       
CONECT   10    9   11   11   39                                       
CONECT   11   10   10   12   41                                       
CONECT   12   11   13   15   15                                       
CONECT   13   12   14                                                 
CONECT   14   13   43   44   45                                       
CONECT   15   12   12   16   42                                       
CONECT   16    9    9   15   40                                       
CONECT   17    8   18   25   25                                       
CONECT   18   17   19   19   46                                       
CONECT   19   18   18   20   48                                       
CONECT   20   19   21   24   24                                       
CONECT   21   20   22   23                                            
CONECT   22   21   50   51   52                                       
CONECT   23   21   53   54   55                                       
CONECT   24   20   20   25   49                                       
CONECT   25   17   17   24   47                                       
CONECT   26    7   27   27   38                                       
CONECT   27    4   26   26   36                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36   27                                                      
CONECT   37    6                                                      
CONECT   38   26                                                      
CONECT   39   10                                                      
CONECT   40   16                                                      
CONECT   41   11                                                      
CONECT   42   15                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   18                                                      
CONECT   47   25                                                      
CONECT   48   19                                                      
CONECT   49   24                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
