16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-37.30773755436595 stress="-10.163349509210903 3.9696755033629625 3.207840139497614 3.9696755033629625 -3.5239314557967063 -7.143974314434409 3.207840139497614 -7.143974314434409 -7.346629879462785" pbc="F F F" Pd -0.14459490 0.11115480 0.11044915 0.54349835 0.56408240 0.39088846 Pd 1.70960170 1.31143450 1.33833517 -1.89389252 1.32240077 1.23206062 Pd 2.78829595 -0.16490224 0.14041416 0.39860549 -1.11864347 -0.70059290 Pd 4.27812781 1.51878885 1.32834452 0.59591193 0.24886222 0.87351255 Pd -0.05990668 2.95894820 0.14004833 -0.05861004 -1.30309356 0.19386870 Pd 1.56504129 4.20865944 1.36550211 -3.28809372 4.76741899 1.63591835 Pd 2.78802619 3.22277084 0.18584377 3.54706912 -1.78800419 -3.84437462 Pd 4.68362810 4.69581920 1.64685009 -1.17955463 -1.17453510 0.70733043 Pd 0.04806263 0.17077661 2.69529298 0.35216783 0.40979371 0.17326177 Pd 1.55137041 1.30875267 4.65300231 -0.00808803 0.64911160 -0.22242983 Pd 2.95834710 0.04848565 3.19072120 -0.57960057 -0.99590834 -1.27523081 Pd 4.45789336 1.38825682 4.20422929 0.08750533 1.50079831 0.06279957 Pd 0.32311538 3.17895518 3.29140871 -3.79384478 -2.88929832 -2.07134057 Pd 1.61455359 4.25846094 4.43409423 1.19197167 3.17419960 3.88951809 Pd 2.78091226 3.10609294 2.96603997 4.17785225 -2.87803420 -0.35071658 Pd 4.30598025 4.32157598 4.51361598 -0.09289766 -0.48915042 -0.69447323