remark goes here MASS ns 14.010 0.530 same as n BOND C -ns 469.06 1.307 c -N 179.24 1.576 c -ns 427.60 1.379 same as c -n ns-hn 403.20 1.013 same as hn-n ns-c3 328.70 1.462 same as c3-n ANGLE O -C -ns 118.37 120.180 C -ns-hn 51.954 113.580 C -ns-c3 64.694 130.190 CX-C -ns 85.818 118.990 o -c -N 98.765 134.880 c -N -H 42.369 120.410 c -N -CX 59.570 126.480 c3-c -N 84.435 101.690 o -c -ns 74.220 123.050 same as n -c -o c -ns-hn 48.330 117.550 same as c -n -hn c -ns-c3 63.390 120.690 same as c -n -c3 c3-c -ns 66.790 115.180 same as c3-c -n ns-c3-h1 49.840 108.880 same as h1-c3-n ns-c3-c 67.000 109.060 same as c -c3-n ns-c3-c3 65.910 111.610 same as c3-c3-n hn-ns-c3 45.800 117.680 same as c3-n -hn DIHE o -c -ns-hn 1 2.500 180.000 -2.000 same as hn-n -c -o o -c -ns-hn 1 2.000 0.000 1.000 same as hn-n -c -o o -c -ns-c3 1 2.500 180.000 2.000 same as X -c -n -X c -ns-c3-h1 1 0.000 0.000 2.000 same as X -c3-n -X c -ns-c3-c 1 0.850 180.000 -2.000 same as c -n -c3-c c -ns-c3-c 1 0.800 0.000 1.000 same as c -n -c3-c c -ns-c3-c3 1 0.500 180.000 -4.000 same as c3-c3-n -c c -ns-c3-c3 1 0.150 180.000 -3.000 same as c3-c3-n -c c -ns-c3-c3 1 0.000 0.000 -2.000 same as c3-c3-n -c c -ns-c3-c3 1 0.530 0.000 1.000 same as c3-c3-n -c c3-c -ns-hn 1 2.500 180.000 2.000 same as X -c -n -X c3-c -ns-c3 1 0.000 0.000 -2.000 same as c3-c -n -c3 c3-c -ns-c3 1 1.500 180.000 1.000 same as c3-c -n -c3 hn-ns-c3-h1 1 0.000 0.000 2.000 same as X -c3-n -X hn-ns-c3-c 1 0.000 0.000 2.000 same as X -c3-n -X hn-ns-c3-c3 1 0.000 0.000 2.000 same as X -c3-n -X c3-ss-cc-cc 1 1.100 180.000 2.000 same as X -c2-ss-X c3-ss-cc-cd 1 1.100 180.000 2.000 same as X -c2-ss-X cc-cd-os-cd 1 1.050 180.000 2.000 same as X -c2-os-X cd-os-cd-c3 1 1.050 180.000 2.000 same as X -c2-os-X h4-cd-os-cd 1 1.050 180.000 2.000 same as X -c2-os-X O -C -ns-hn 1 2.500 180.000 -2.000 O -C -ns-c3 1 2.000 0.000 1.000 C -ns-c3-h1 1 0.000 0.000 2.000 C -ns-c3-c 1 0.850 180.000 -2.000 C -ns-c3-c3 1 0.500 180.000 -4.000 CX-C -ns-hn 1 0.000 0.000 2.000 CX-C -ns-c3 1 1.100 180.000 2.000 o -c -N -H 1 2.000 0.000 1.000 o -c -N -CX 1 2.500 180.000 2.000 c3-c -N -H 1 2.500 180.000 2.000 c3-c -N -CX 1 0.530 0.000 1.000 O -C -ns-c3 1 2.500 180.000 2.000 C -ns-c3-c3 1 0.500 180.000 -4.000 CX-C -ns-hn 1 1.100 180.000 2.000 CX-C -ns-hn 1 0.000 0.000 2.000 IMPROPER c3-ns-c -o 10.5 180.0 2.0 General improper torsional angle (2 general atom types) c -c3-ns-hn 1.1 180.0 2.0 Using default value cc-cd-cc-ss 1.1 180.0 2.0 Using default value cc-cd-cc-ha 1.1 180.0 2.0 Using default value cc-h4-cd-os 1.1 180.0 2.0 Using default value c3-cc-cd-os 1.1 180.0 2.0 Using default value NONBON ns 1.8240 0.1700 same as n