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=119.86780977664645 stress="-20.072037731887544 3.2645294938265437 -0.8451545483251103 3.2645294938265437 -17.420408267408423 -1.86584022912422 -0.8451545483251103 -1.86584022912422 -22.016316761678425" pbc="T F T" Cr -0.00792870 0.15300231 0.03848316 -63.51198905 -151.81150381 68.39985653 Cr 1.45774659 1.41852158 -0.04210664 127.76113596 189.78371044 78.05055010 Cr 1.38825682 0.19178619 1.67895518 109.59138629 -200.78785041 -116.42661348 Cr 0.29140871 1.61455359 1.53253581 -173.84053320 162.81564378 -30.02379315