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=20.9312660383 stress="-11.26599154368486 2.2715156844969306 -0.8160626472071453 2.2715156844969306 -12.291430238150863 0.4326912016511662 -0.8160626472071453 0.4326912016511662 -10.742179620535747" pbc="F F F" Cd -0.12320595 -0.04105180 0.20259391 -21.76279579 -14.99279244 -14.30878244 Cd 1.56504129 1.20865944 -0.13449789 15.82422904 12.77206458 -20.07161537 Cd 1.28802619 0.22277084 1.68584377 28.66673400 -31.13102274 25.07898920 Cd 0.18362810 1.69581920 1.64685009 -22.72816725 33.35175060 9.30140861