Remark line goes here MASS BOND ANGLE c -cc-na 68.740 123.270 same as c2-cc-na, penalty score= 2.6 DIHE IMPROPER h5-na-cc-nd 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 67.5 (use general term)) c -cd-cc-na 1.1 180.0 2.0 Using the default value cc-na-cd-nd 1.1 180.0 2.0 Using the default value cc-nd-c -s 1.1 180.0 2.0 Using the default value na-nd-cc-nh 1.1 180.0 2.0 Using the default value cc-cc-na-hn 1.1 180.0 2.0 Using general improper torsional angle X- X-na-hn, penalty score= 6.0) cc-cd-na-hn 1.1 180.0 2.0 Using general improper torsional angle X- X-na-hn, penalty score= 6.0) cc-hn-nh-hn 1.1 180.0 2.0 Same as X -X -na-hn, penalty score= 41.2 (use general term)) NONBON