Remark line goes here MASS BOND ANGLE DIHE IMPROPER c -c3-n -c3 1.1 180.0 2.0 Using general improper torsional angle X-c3- n-c3, penalty score= 3.0) n -n -c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0) c -ca-n -hn 1.1 180.0 2.0 Using general improper torsional angle X- X- n-hn, penalty score= 6.0) ca-ca-ca-n 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) NONBON