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=15.0910597194 stress="-10.07611791210089 2.304301868926913 2.295379343307939 2.304301868926913 -8.270033851896683 0.46840482757866686 2.295379343307939 0.46840482757866686 -8.830663781226448" pbc="F F F" O 0.23171545 0.18190327 -0.17816502 -5.24096662 -6.62733941 -8.08627603 O 1.71219253 1.42485375 0.12990665 11.75283112 9.27083318 -11.29530306 O 1.28220450 0.28278197 1.56210000 14.42782269 -19.06664065 9.35003672 O 0.13362859 1.32702941 1.57034430 -20.93968719 16.42314689 10.03154237