vasp 5.4.4 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex MareNostrum4 2022-03-21T17:17:06.000 13.668515302 13.668515302 18.83259964 90.0 90.0 90.0 10921.915800000004 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