remark goes here MASS BOND ANGLE n2-ce-nh 72.600 124.270 same as n2-c2-nh nh-ce-ca 65.902 117.690 Calculated with empirical approach DIHE n2-ce-nh-hn 1 0.675 180.000 2.000 same as X -c2-nh-X n2-ce-ca-ca 1 2.550 180.000 2.000 same as X -c2-ca-X hn-n2-ce-nh 1 4.150 180.000 2.000 same as X -c2-n2-X hn-n2-ce-ca 1 4.150 180.000 2.000 same as X -c2-n2-X nh-ce-ca-ca 1 2.550 180.000 2.000 same as X -c2-ca-X hn-nh-ce-ca 1 0.675 180.000 2.000 same as X -c2-nh-X IMPROPER ca-n2-ce-nh 1.1 180.0 2.0 Using default value ca-ca-ca-ce 1.1 180.0 2.0 Using default value ca-ca-ca-ha 1.1 180.0 2.0 General improper torsional angle (2 general atom types) ca-ca-ca-nd 1.1 180.0 2.0 Using default value ca-ca-ca-na 1.1 180.0 2.0 Using default value ca-cc-na-hn 1.1 180.0 2.0 General improper torsional angle (2 general atom types) h5-na-cc-nd 1.1 180.0 2.0 Using default value NONBON