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=22.49972179093731 stress="-3.126155576521976 0.23719498777734652 -0.18337868486159276 0.23719498777734652 -3.1623458620791047 -0.28134503509426617 -0.18337868486159276 -0.28134503509426617 -3.547626869819254" pbc="T T T" Al -0.14459490 0.11115480 0.11044915 9.45086041 -19.80339179 -5.64249919 Al 1.70960170 1.31143450 -0.16166483 -15.20253040 16.15103983 2.96502162 Al 1.28829595 0.03769167 1.64041416 -2.90921936 -12.95517488 -4.66609700 Al -0.22187219 1.22744829 1.32834452 8.66088935 16.60752683 7.34357457