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=-0.4959416857872334 stress="-32.406339459248386 8.92163307256461 -3.0938411774138004 8.92163307256461 -36.44563522849104 1.9955461715076872 -3.0938411774138004 1.9955461715076872 -28.840714632138088" pbc="F F F" Au -0.12320595 -0.04105180 0.20259391 -11.14375637 -7.26417685 -7.29782943 Au 1.56504129 1.20865944 -0.13449789 7.66290933 6.60785300 -9.98326931 Au 1.28802619 0.22277084 1.68584377 16.66193714 -18.36177128 13.26119504 Au 0.18362810 1.69581920 1.64685009 -13.18109010 19.01809514 4.01990370