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=6.918318409293187 stress="-2.1125617882701944 -0.01689998880777626 -0.03671863746187245 -0.01689998880777626 -1.6404671272101183 0.11101603023618341 -0.03671863746187245 0.11101603023618341 -1.7643937143387818" free_energy=6.918318409293187 pbc="T F F" V 0.03310309 0.23956773 0.14408857 -6.90181529 -11.13965207 -23.15866099 V 1.42913583 1.70902946 0.16265408 4.70361349 17.95870920 -14.80863633 V 1.45874788 0.04052745 1.23417086 5.86508819 -16.90077223 21.92967580 V 0.06122572 1.68168807 1.64109445 -3.66688640 10.08171511 16.03762152