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XJE.frcmod
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MASS
BOND
ANGLE
DIHE
ca-ca-cd-cc 1 3.770 180.000 2.000 same as ca-ca-ce-cc, penalty score=142.0
ca-ca-cd-c3 1 0.600 180.000 2.000 same as ca-ca-ce-c3, penalty score=142.0
IMPROPER
ca-ca-ca-os 1.1 180.0 2.0 Using the default value
ca-ca-ca-ha 1.1 180.0 2.0 Using general improper torsional angle X- X-ca-ha, penalty score= 6.0)
cc-o -c -os 10.5 180.0 2.0 Same as X -X -c -o , penalty score= 24.5 (use general term))
c -cd-cc-ha 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 38.9 (use general term))
c3-ca-cd-cc 1.1 180.0 2.0 Using the default value
ca-ca-ca-cd 1.1 180.0 2.0 Using the default value
NONBON