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:Z:I:1:forces:R:3 energy=1100122.677661717 pbc="T T T" Na 0.00547159 -0.07813297 -0.25627017 11 -3123330.89751586 717609.14349545 -4796511.16811357 Na 1.04892345 0.63284922 -0.01790603 11 1107553.50708192 833887.57133796 -674001.23624959 Na 0.52998806 -0.29823056 0.66878957 11 3504669.23966665 -5647802.60448402 3718644.51531857 Na 0.23254767 0.71399842 0.99331949 11 -1488891.84923271 4096305.88965061 1751867.88904458