Remark line goes here MASS BOND ANGLE c -cc-na 67.795 118.565 Calculated using nh-cc- c, penalty score= 3.0 DIHE IMPROPER c3-cc-na-cc 1.1 180.0 2.0 Using the default value h5-na-cc-nd 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 67.5 (use general term)) cc-n -cd-nd 1.1 180.0 2.0 Using the default value c -cd-cc-na 1.1 180.0 2.0 Using the default value cc-n -c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0) c -c -n -c3 1.1 180.0 2.0 Using the default value n -n -c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0) c -c3-n -cd 1.1 180.0 2.0 Using the default value NONBON