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=694.3557920149269 stress="-28.25384376276741 -0.7257633883212586 0.4102298253989254 -0.7257633883212586 -24.89069049800925 0.3297792222517075 0.4102298253989254 0.3297792222517075 -41.799807014853755" free_energy=694.3557920149269 pbc="F F T"
I       0.07022621       0.10537101       2.70641190    -279.77230599    -259.37792929     144.15177599 
I       1.76767637       1.21243667       2.79960156     282.81568559     227.35157196     131.57997549 
I       1.39723558       0.17842378       1.64553500     226.18198993    -294.69435145    -170.66242739 
I       0.14594781       1.45785282       1.74717822    -229.22536954     326.72070878    -105.06932408