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Copy path24M.frcmod
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24M.frcmod
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MASS
BOND
ANGLE
DIHE
c5-c3-c3-n8 1 0.520 0.000 3.000 same as c3-c3-c3-n8, penalty score= 0.0
c3-c3-c5-c5 1 0.520 0.000 3.000 same as c3-c3-c3-c3, penalty score= 0.0
c3-c3-c5-hc 1 0.130 0.000 3.000 same as c3-c3-c3-hc, penalty score= 0.0
c3-c5-c5-c5 1 0.520 0.000 3.000 same as c3-c3-c3-c3, penalty score= 0.0
c -c5-c5-c3 1 0.000 0.000 -3.000 same as c -c3-c3-c3
c -c5-c5-c3 1 0.040 0.000 -2.000 same as c -c3-c3-c3
c -c5-c5-c3 1 0.460 180.000 1.000 same as c -c3-c3-c3, penalty score= 0.0
c3-c5-c5-hc 1 0.130 0.000 3.000 same as c3-c3-c3-hc, penalty score= 0.0
oh-c3-c5-c5 1 0.180 0.000 3.000 same as c3-c3-c3-oh, penalty score= 0.0
oh-c3-c5-hc 1 0.090 0.000 3.000 same as hc-c3-c3-oh, penalty score= 0.0
c5-c3-oh-ho 1 0.060 0.000 3.000 same as c3-c3-oh-ho, penalty score= 0.0
c5-c5-c5-c5 1 0.520 0.000 3.000 same as c3-c3-c3-c3, penalty score= 0.0
c5-c5-c5-hc 1 0.130 0.000 3.000 same as c3-c3-c3-hc, penalty score= 0.0
o -c -c5-c5 1 0.200 180.000 -2.000 same as o -c -c3-c3
o -c -c5-c5 1 0.440 180.000 -3.000 same as o -c -c3-c3
o -c -c5-c5 1 0.680 0.000 1.000 same as o -c -c3-c3, penalty score= 0.0
c -c5-c5-c5 1 0.000 0.000 -3.000 same as c -c3-c3-c3
c -c5-c5-c5 1 0.040 0.000 -2.000 same as c -c3-c3-c3
c -c5-c5-c5 1 0.460 180.000 1.000 same as c -c3-c3-c3, penalty score= 0.0
c -c5-c5-hc 9 1.400 0.000 3.000 same as X -c3-c3-X , penalty score= 0.0
c3-c3-c3-c5 1 0.520 0.000 3.000 same as c3-c3-c3-c3, penalty score= 0.0
h1-c3-n8-hn 6 1.800 0.000 3.000 same as X -c3-n3-X , penalty score= 0.0
h1-c3-c5-c5 9 1.400 0.000 3.000 same as X -c3-c3-X , penalty score= 0.0
h1-c3-c5-hc 9 1.400 0.000 3.000 same as X -c3-c3-X , penalty score= 0.0
hc-c5-c5-hc 1 0.120 0.000 3.000 same as hc-c3-c3-hc, penalty score= 0.0
o -c -c5-hc 1 4.030 0.000 -1.000 same as o -c -c3-hc
o -c -c5-hc 1 3.660 180.000 2.000 same as o -c -c3-hc, penalty score= 0.0
IMPROPER
c5-o -c -o 1.1 180.0 2.0 Using general improper torsional angle X- o- c- o, penalty score= 3.0)
NONBON