sim/src/tests/floppy_organics/C6H14c.pdb


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COMPND  C6H14c.pdb                                                              
HETATM    1  C                   0.040  -0.767  -0.057                
HETATM    2  C                   0.031   0.786  -0.162                
HETATM    3  C                   1.182   1.422   0.634                
HETATM    4  C                  -0.294  -1.296   1.346                
HETATM    5  C                  -0.872  -1.417  -1.111                
HETATM    6  C                  -1.312   1.425   0.230                
HETATM    7  H                   1.070  -1.078  -0.287                
HETATM    8  H                   0.206   1.020  -1.223                
HETATM    9  H                   1.220   2.505   0.475                
HETATM   10  H                   1.064   1.254   1.710                
HETATM   11  H                   2.151   1.007   0.334                
HETATM   12  H                  -0.203  -2.387   1.379                
HETATM   13  H                  -1.322  -1.048   1.635                
HETATM   14  H                   0.372  -0.889   2.114                
HETATM   15  H                  -0.745  -2.505  -1.121                
HETATM   16  H                  -0.642  -1.042  -2.114                
HETATM   17  H                  -1.931  -1.216  -0.913                
HETATM   18  H                  -1.523   1.296   1.298                
HETATM   19  H                  -1.300   2.503   0.030                
HETATM   20  H                  -2.151   1.000  -0.330                
CONECT    1    2    4    5    7                              
CONECT    2    1    3    6    8                              
CONECT    3    2    9   10   11                              
CONECT    4    1   12   13   14                              
CONECT    5    1   15   16   17                              
CONECT    6    2   18   19   20                              
CONECT    7    1                                             
CONECT    8    2                                             
CONECT    9    3                                             
CONECT   10    3                                             
CONECT   11    3                                             
CONECT   12    4                                             
CONECT   13    4                                             
CONECT   14    4                                             
CONECT   15    5                                             
CONECT   16    5                                             
CONECT   17    5                                             
CONECT   18    6                                             
CONECT   19    6                                             
CONECT   20    6                                             
END