4
Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=770.8119689503471 stress="-705.2799255884133 -24.794145034661057 47.9999201117593 -24.794145034661057 -917.8234464883224 233.15454123599207 47.9999201117593 233.15454123599207 -730.3685608040158" pbc="F T F"
user01       0.08004885       0.13417175       0.33595892   -3022.21066195   -1068.73719412   -1795.11411780 
user01       0.63813862       0.46439497       0.41657831    3270.39106038    4420.70761835   -3563.56728002 
user01       0.56425730      -0.01155935       0.78277713    1702.94117920   -5548.96173734    3139.99507478 
user01       0.21813893       0.51716069       0.94410236   -1951.12157764    2196.99131311    2218.68632303