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=-5.902501249336212 stress="-23.485715116309812 2.048004012464621 -4.905436364627807 2.048004012464621 -35.6867775028596 -15.350199879623437 -4.905436364627807 -15.350199879623437 -33.17703134898239" pbc="F F F"
Mo      -0.14459490       0.11115480       0.11044915      -9.33074662     -19.15209335     -20.81053348 
Mo       1.70960170       1.31143450      -0.16166483       6.06660171       4.15939257      -3.43329157 
Mo       1.28829595      -0.16490224       1.64041416       8.27013017      -5.69588261       8.70428298 
Mo      -0.22187219       1.51878885       1.32834452      -5.00598526      20.68858339      15.53954207