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=16.862063797583275 stress="-2.7738541713168496 1.2041352299696895 -0.3610944671444132 1.2041352299696895 -2.8747150174075795 -0.3879722198531097 -0.3610944671444132 -0.3879722198531097 -2.1352533431209544" free_energy=16.862063797583275 pbc="T F F"
Ne       0.15839933       0.09073906       0.27219963     -11.10256651     -27.69621521     -31.28219347
Ne       1.43381326       1.45316417       0.25978669      11.99299812      10.37745306     -12.69726454
Ne       1.22592512       0.18365717       1.70288723      42.95834850     -38.30949783      22.68121950
Ne       0.08343331       1.29585403       1.44809454     -43.84878011      55.62825998      21.29823851