1
Lattice="-3.274433 0.0 0.0 0.0 -3.274433 0.0 1.637216 1.637216 2.488566" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2.7630581497534417 stress="-0.004249120219154728 -0.00028054372581358714 -0.0003390441231580266 -0.00028054372581358714 -0.004249120219154728 -0.0003390441231580266 -0.0003390441231580266 -0.0003390441231580266 -0.006411011444065415" dipole="-4.0077910000638735e-15 6.811466563627945e-15 1.7239714848184798e-15" pbc="T T T"
In       0.00000000       0.00000000       0.00000000       0.00000000       0.00000000       0.00000000