4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=59973.80022405464 stress="-197673.74150859413 -5937.373599725234 -27333.342916179623 -5937.373599725234 -302829.4350456953 133864.15592475247 -27333.342916179623 133864.15592475247 -229543.1641785411" pbc="F F F" La -0.18978317 -0.06264504 0.23233972 -83059.49366124 -27946.63144454 -58103.42893523 La 1.68107628 1.50851837 0.06436079 35322.24377346 155576.72786033 -136071.24320629 La 1.56580519 0.01142140 1.21119471 80941.65825130 -170059.19802783 153185.11884040 La 0.12672437 1.61046727 1.61659598 -33204.40836352 42429.10161204 40989.55330112