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=1.6788963235020036 stress="-38.01012998484162 -4.283709663163743 0.10049911072755258 -4.283709663163743 -30.027872125952914 2.6485485348471833 0.10049911072755258 2.6485485348471833 -28.344248987526743" pbc="F F F"
Mo       0.05332204      -0.11563527       0.23110688     -13.17564792     -10.75016874      -9.80120515 
Mo       1.49816022       1.51283276       0.20071341      16.59284919      10.21808683     -12.88101641 
S       1.32858036       0.14720807       1.58942344       9.99420679      -7.60366948      15.08828477 
S      -0.04293576       1.77559981       1.21321713     -13.41140806       8.13575139       7.59393678