mirror of
https://github.com/cp2k/cp2k.git
synced 2026-07-28 06:05:29 -04:00
intermediate hack removed
svn-origin-rev: 1669
This commit is contained in:
parent
d3edbc5c44
commit
f0c76c21cd
1 changed files with 1 additions and 2 deletions
|
|
@ -1,6 +1,5 @@
|
|||
REMARK PDB
|
||||
REMARK TITLE
|
||||
&COORD pdb
|
||||
ATOM 1 O TIP3 0 -4.583 5.333 1.560 1.00 0.00 WAT
|
||||
ATOM 2 H TIP3 0 -3.777 5.331 0.943 1.00 0.00 WAT
|
||||
ATOM 3 H TIP3 0 -5.081 4.589 1.176 1.00 0.00 WAT
|
||||
|
|
@ -97,4 +96,4 @@ ATOM 93 H TIP3 30 -0.403 -1.349 0.873 1.00 0.00 WAT
|
|||
ATOM 94 O TIP3 31 3.655 3.021 0.988 1.00 0.00 WAT
|
||||
ATOM 95 H TIP3 31 2.706 3.053 1.282 1.00 0.00 WAT
|
||||
ATOM 96 H TIP3 31 3.542 2.615 0.020 1.00 0.00 WAT
|
||||
&END
|
||||
END
|
||||
|
|
|
|||
Loading…
Add table
Add a link
Reference in a new issue