| 1 |
|
begin ShapeInfo |
| 2 |
|
#name mass I_xx I_yy I_zz |
| 3 |
< |
linear 48.0428 86.477 86.477 0 |
| 3 |
> |
linear 48.0428 86.477 86.477 0 |
| 4 |
|
end ShapeInfo |
| 5 |
|
|
| 6 |
|
begin ContactFunctions |
| 7 |
|
#l m sin or cos coeff (Ang) |
| 8 |
< |
0 0 cos 4.32851 |
| 9 |
< |
2 0 cos 2.64072 |
| 10 |
< |
6 0 cos -0.146442 |
| 8 |
> |
0 0 cos 4.35343 |
| 9 |
> |
2 0 cos 2.60069 |
| 10 |
> |
4 0 cos -0.125308 |
| 11 |
> |
6 0 cos -0.0743899 |
| 12 |
|
end ContactFunctions |
| 13 |
|
|
| 14 |
|
begin RangeFunctions |
| 15 |
|
#l m sin or cos coeff (Ang) |
| 16 |
< |
0 0 cos 3.56035 |
| 17 |
< |
2 0 cos 0.28064 |
| 18 |
< |
4 0 cos 0.104529 |
| 19 |
< |
6 0 cos 0.285028 |
| 16 |
> |
0 0 cos 3.71718 |
| 17 |
> |
4 0 cos -0.844367 |
| 18 |
> |
6 0 cos 0.33514 |
| 19 |
> |
8 0 cos 0.395519 |
| 20 |
> |
10 0 cos -1.23786 |
| 21 |
> |
12 0 cos 0.300902 |
| 22 |
> |
14 0 cos 1.05381 |
| 23 |
|
end RangeFunctions |
| 24 |
|
|
| 25 |
|
begin StrengthFunctions |
| 26 |
|
#l m sin or cos coeff (kcal/mol) |
| 27 |
< |
0 0 cos 0.705782 |
| 28 |
< |
2 0 cos -0.793274 |
| 29 |
< |
4 0 cos 0.3388 |
| 30 |
< |
6 0 cos -0.045476 |
| 27 |
> |
0 0 cos 0.784136 |
| 28 |
> |
2 0 cos -0.85371 |
| 29 |
> |
4 0 cos 0.391814 |
| 30 |
> |
6 0 cos -0.102928 |
| 31 |
|
end StrengthFunctions |
