remark goes here MASS CT 12.010 0.878 same as c3 HC 1.008 0.135 same as hc BOND CT-HC 337.30 1.092 same as c3-hc CT-CT 303.10 1.535 same as c3-c3 ANGLE CT-CT-HC 46.400 110.050 same as c3-c3-hc CT-CT-CT 63.200 110.630 same as c3-c3-c3 HC-CT-HC 39.400 108.350 same as hc-c3-hc DIHE CT-CT-CT-HC 1 0.156 0.000 3.000 same as X -c3-c3-X CT-CT-CT-CT 1 0.156 0.000 3.000 same as X -c3-c3-X HC-CT-CT-HC 1 0.156 0.000 3.000 same as X -c3-c3-X IMPROPER NONBON CT 1.9080 0.1094 same as c3 HC 1.4870 0.0157 same as hc