Dateien nach "Kaffee/caffeine" hochladen

2026-05-04 11:06:32 +02:00
parent c44dde87b2
commit 1aab83cb87
5 changed files with 51 additions and 0 deletions
@@ -0,0 +1,2 @@
+!PBE D4 DEF2-SVP OPT
+* xyzfile 0 1 orca.xyz