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=75.87927985111281 stress="-4.624960287949188 0.11814724607557721 -0.1605669615321079 0.11814724607557721 -7.536697036867568 0.06248420004714589 -0.1605669615321079 0.06248420004714589 -7.582440200638289" free_energy=75.87927985111281 pbc="F T T" Se 0.13616082 2.76429260 0.42736672 -46.83161677 15.61514132 -21.89363946 Se 1.71980528 1.79977655 0.16817496 43.57006509 -13.79940438 -8.78495015 Se 1.45460942 0.07327937 1.56055390 42.18559470 14.07661858 13.92338898 Se 0.12961200 1.54515470 1.62731530 -38.92404301 -15.89235552 16.75520062