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=120.385734439 stress="-89.2515079502422 7.7846370404013205 1.1303758365390408 7.7846370404013205 -90.8345164479852 -5.347074657852681 1.1303758365390408 -5.347074657852681 -63.73643258576262" pbc="F F F" U -0.08338442 -0.03487808 0.22586561 -118.90349975 -111.62987771 -101.48781626 U 1.79391194 1.22614529 0.02103145 115.88929940 61.49137684 -107.97014851 U 1.27761356 0.18220204 1.39362841 135.47434432 -156.26500187 126.01694243 U 0.23573857 1.52724172 1.27538150 -132.46014397 206.40350274 83.44102233