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=76597.41337719023 stress="-344722.3549222893 -123664.67317437992 -86349.79842967444 -123664.67317437992 -275223.6440616944 34622.07419917491 -86349.79842967444 34622.07419917491 -309269.96186235634" pbc="F F F"
Ra       0.23698464       0.18734388      -0.22744496 -190103.80985982 -114302.27490557 -146948.21244478 
Ra       1.79888928       1.34698057       0.03888080  168946.34532104  154437.93204221  -38095.96903187 
Ra       1.25477488      -0.02343879       1.51601049   62090.86435246  -93072.62189285  155723.55729149 
Ra      -0.19417424       1.63271682       1.40685909  -40933.39981368   52936.96475621   29320.62418516