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=-90.71234007004217 stress="5.142653233331536 0.6643711980560525 0.29091077428837814 0.6643711980560525 7.900722571525192 -0.5984819684811482 0.29091077428837814 -0.5984819684811482 4.979374508922286" pbc="F T F" He 0.05473499 -0.12063495 0.13661615 64.17651328 -3.37769926 59.11548853 He 1.40480033 1.28303047 0.11041876 -44.03880295 -6.48491757 48.95845236 He 1.26735611 -0.16466555 1.24148635 -66.67944764 -8.03601248 -59.73402609 He 0.08611608 1.53369179 1.52598936 46.54173731 17.89862931 -48.33991480