; chloroform_GMX.itp created by acpype (Rev: 7268) on Sat Sep 28 21:37:07 2013

[ moleculetype ]
;name            nrexcl
 chloroform       3

[ atoms ]
;   nr  type  resi  res  atom  cgnr     charge      mass       ; qtot   bond_type
     1   c3     1   TCM     C    1     0.224500     12.01000 ; qtot 0.225
     2   h3     1   TCM     H    2     0.118700      1.00800 ; qtot 0.343
     3   cl     1   TCM    CL    3    -0.114400     35.45000 ; qtot 0.229
     4   cl     1   TCM   CL1    4    -0.114400     35.45000 ; qtot 0.114
     5   cl     1   TCM   CL2    5    -0.114400     35.45000 ; qtot 0.000

[ bonds ]
;   ai     aj funct   r             k
     1      2   1    1.0948e-01    2.7899e+05 ;      C - H     
     1      3   1    1.7860e-01    2.3347e+05 ;      C - CL    
     1      4   1    1.7860e-01    2.3347e+05 ;      C - CL1   
     1      5   1    1.7860e-01    2.3347e+05 ;      C - CL2   

[ angles ]
;   ai     aj     ak    funct   theta         cth
     2      1      3      1    1.0765e+02    3.6284e+02 ;      H - C      - CL    
     2      1      4      1    1.0765e+02    3.6284e+02 ;      H - C      - CL1   
     2      1      5      1    1.0765e+02    3.6284e+02 ;      H - C      - CL2   
     3      1      4      1    1.1103e+02    5.2467e+02 ;     CL - C      - CL1   
     3      1      5      1    1.1103e+02    5.2467e+02 ;     CL - C      - CL2   
     4      1      5      1    1.1103e+02    5.2467e+02 ;    CL1 - C      - CL2