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=-46.369017603984126 stress="0.6670983415638858 -0.8538196103042335 11.267769862116872 -0.8538196103042335 -0.6911148590476626 3.8733596371117542 11.267769862116872 3.8733596371117542 -0.5485532058926701" pbc="F F F" Pd -0.06801106 -0.17256882 -0.20453718 1.08502308 0.88132331 1.10267125 Pd 1.10841812 1.61893942 1.22956938 -0.98178431 -1.17109385 1.16326982 Pd 2.75698165 0.27139687 0.23010044 0.59247846 -1.49725768 -1.10288687 Pd 4.59566688 1.37823688 1.38100890 -0.45522277 0.87290038 0.69937801 Pd 0.17828948 3.39054365 -0.20698176 -1.06593207 -0.60755877 -2.00574104 Pd 1.23241985 4.57255377 1.51129231 3.67159414 3.16722593 -0.30738156 Pd 3.20363550 3.13762329 -0.19545900 -0.02795519 -0.16794789 1.51794406 Pd 4.62365747 4.45588739 1.40581136 -1.08156654 -1.12748819 0.51915303 Pd -0.15318125 -0.13105901 3.04737131 1.58500316 1.36128809 -0.76635040 Pd 1.53238783 1.74404962 4.36810690 -4.43766566 -5.85144683 4.29858621 Pd 2.91290840 -0.24181915 2.79192604 -0.47360681 1.48243224 -0.30801666 Pd 4.29640878 1.72685632 4.77913633 -0.98159806 0.88702425 -1.02856761 Pd -0.14736324 3.18492541 2.67806587 -2.90950213 -1.94125955 2.31722371 Pd 1.38323780 4.26192411 4.46490969 -0.40224884 1.79552332 1.02574376 Pd 2.76260376 2.91324852 3.04530481 6.93408485 3.53429573 -5.96228117 Pd 4.45206007 4.62593290 4.34000708 -1.05110132 -1.61796048 -1.16274454