|
| EXPAND | Option | Code | Arg | Def | |
| expansion extent |
cell
|
|
fill
cells |
1
|
|
| contract to independents |
|
||||
| site overlap tolerance |
|
|
separation
in Angstroms |
0.1
|
|
| move atoms within tolerance to special sites |
|
|
distance
in Angstroms |
0.4
|
|
| atom name strip |
|
don't strip symm from name |