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Copy pathXCJ.frcmod
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XCJ.frcmod
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MASS
BOND
ANGLE
DIHE
c3-c -ns-cc 1 0.210 180.000 2.000 same as c3-c -n -cc, penalty score= 0.0
c3-c -ns-hn 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
cc-cd-ss-cd 1 2.430 180.000 1.000 same as cd-cc-ss-c2, penalty score=254.0
nd-cc-ns-c 4 6.600 180.000 2.000 same as X -n -cc-X , penalty score= 0.0
nd-cc-ns-hn 4 6.600 180.000 2.000 same as X -n -cc-X , penalty score= 0.0
nd-cc-ss-ca 2 3.200 180.000 2.000 same as n2-c2-ss-ca, penalty score=319.0
ns-cc-ss-ca 2 2.200 180.000 2.000 same as X -c2-ss-X , penalty score=232.0
na-cd-ss-cd 2 2.200 180.000 2.000 same as X -c2-ss-X , penalty score=232.0
nc-cd-ss-cd 2 3.200 180.000 2.000 same as n2-c2-ss-ca, penalty score=406.0
o -c -ns-cc 4 10.000 180.000 2.000 same as X -c -n -X , penalty score= 0.0
o -c -ns-hn 1 2.500 180.000 -2.000 same as o -c -n -hn
o -c -ns-hn 1 2.000 0.000 1.000 same as o -c -n -hn, penalty score= 0.0
ss-cc-ns-c 4 6.600 180.000 2.000 same as X -n -cc-X , penalty score= 0.0
ss-cc-ns-hn 4 6.600 180.000 2.000 same as X -n -cc-X , penalty score= 0.0
h4-cd-ss-cd 2 2.200 180.000 2.000 same as X -c2-ss-X , penalty score=232.0
IMPROPER
ca-ca-ca-sy 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)
ca-ca-ca-ss 1.1 180.0 2.0 Using the default value
ca-ca-ca-nd 1.1 180.0 2.0 Using the default value
nd-ns-cc-ss 1.1 180.0 2.0 Using the default value
c3-ns-c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0)
c3-cd-cc-nc 1.1 180.0 2.0 Using the default value
cc-h4-cd-ss 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 67.2 (use general term))
na-nc-cd-ss 1.1 180.0 2.0 Using the default value
cd-h4-cc-na 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 67.2 (use general term))
cc-cd-cd-ha 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 38.9 (use general term))
c -cc-ns-hn 1.1 180.0 2.0 Same as X -X -n -hn, penalty score= 6.0 (use general term))
cc-cc-na-cd 1.1 180.0 2.0 Using the default value
NONBON