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=30.973453283469468 stress="-116.53960481123343 12.080400558848753 -34.35731900065148 12.080400558848753 -88.59577022985421 -12.52945130948764 -34.35731900065148 -12.52945130948764 -127.67123479567533" pbc="F F F" Re 0.19178619 0.17895518 0.29140871 -55.65967933 -39.34836538 -86.89354209 Re 1.61455359 1.53253581 0.14904689 22.36857630 27.14864208 -18.11235897 Re 1.28091226 0.10609294 1.46603997 66.14422106 -31.18779554 68.23290329 Re -0.19401975 1.32157598 1.51361598 -32.85311802 43.38751884 36.77299777