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=53.08636386129291 stress="-7.199716272834876 -1.4327291813352632 -0.38292306551961275 -1.4327291813352632 -7.580641563760327 1.2980056771416995 -0.38292306551961275 1.2980056771416995 -5.166726363174854" pbc="T T F" Au -0.13449789 -0.21197381 0.22277084 38.80818856 52.80663452 -52.40476699 Au 1.68584377 1.68362810 0.19581920 -49.64688710 -27.22028002 -50.80674025 Au 1.64685009 0.42259636 1.67626233 -25.82485607 -17.93253840 38.68740814 Au -0.14597521 1.70996341 1.49207130 36.66355461 -7.65381609 64.52409910