path: root/sim/src/tests/floppy_organics/C4H10b.pdb

COMPND  C4H10b.pdb                                                              
HETATM    1  C                   0.811  -0.628  -1.443                
HETATM    2  C                  -0.541  -0.560  -0.723                
HETATM    3  C                  -0.449  -0.600   0.812                
HETATM    4  C                   0.186   0.648   1.435                
HETATM    5  H                   0.681  -0.611  -2.529                
HETATM    6  H                   1.346  -1.551  -1.185                
HETATM    7  H                   1.460   0.214  -1.176                
HETATM    8  H                  -1.168  -1.395  -1.062                
HETATM    9  H                  -1.070   0.356  -1.026                
HETATM   10  H                  -1.460  -0.729   1.220                
HETATM   11  H                   0.118  -1.491   1.116                
HETATM   12  H                   0.193   0.589   2.529                
HETATM   13  H                   1.222   0.787   1.110                
HETATM   14  H                  -0.372   1.551   1.157                
CONECT    1    2    5    6    7                              
CONECT    2    1    3    8    9                              
CONECT    3    2    4   10   11                              
CONECT    4    3   12   13   14                              
CONECT    5    1                                             
CONECT    6    1                                             
CONECT    7    1                                             
CONECT    8    2                                             
CONECT    9    2                                             
CONECT   10    3                                             
CONECT   11    3                                             
CONECT   12    4                                             
CONECT   13    4                                             
CONECT   14    4                                             
END