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=3.859845989114857 stress="-0.4262805918054827 -0.03107614956607061 -0.12492593659684463 -0.03107614956607061 -0.8994714759098094 -0.0802790987707694 -0.12492593659684463 -0.0802790987707694 -0.5576665972987066" free_energy=3.859845989114857 pbc="T T T" N 2.78604778 0.20384132 2.79224623 -1.84212389 -3.81332855 -3.49014257 N 1.23214964 1.50041025 0.25551247 -3.14898216 1.90927812 0.84534793 N 1.35444624 2.99188881 1.56482696 1.22008305 0.46942655 3.47887463 N 2.84620060 1.51821382 1.20575425 3.77102301 1.43462388 -0.83407999