16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-46.36901760398413 stress="9.004134833760827e-06 -1.1524398152256556e-05 0.00015208630091400688 -1.1524398152256556e-05 -9.328296877330732e-06 5.228052636205363e-05 0.00015208630091400688 5.228052636205363e-05 -7.40407631320459e-06" pbc="F F F" Pd 20.93198894 20.82743118 20.79546282 1.08502308 0.88132331 1.10267125 Pd 22.10841812 22.61893942 22.22956938 -0.98178431 -1.17109385 1.16326982 Pd 23.75698165 21.27139687 21.23010044 0.59247846 -1.49725768 -1.10288687 Pd 25.59566688 22.37823688 22.38100890 -0.45522277 0.87290038 0.69937801 Pd 21.17828948 24.39054365 20.79301824 -1.06593207 -0.60755877 -2.00574104 Pd 22.23241985 25.57255377 22.51129231 3.67159414 3.16722593 -0.30738156 Pd 24.20363550 24.13762329 20.80454100 -0.02795519 -0.16794789 1.51794406 Pd 25.62365747 25.45588739 22.40581136 -1.08156654 -1.12748819 0.51915303 Pd 20.84681875 20.86894099 24.04737131 1.58500316 1.36128809 -0.76635040 Pd 22.53238783 22.74404962 25.36810690 -4.43766566 -5.85144683 4.29858621 Pd 23.91290840 20.75818085 23.79192604 -0.47360681 1.48243224 -0.30801666 Pd 25.29640878 22.72685632 25.77913633 -0.98159806 0.88702425 -1.02856761 Pd 20.85263676 24.18492541 23.67806587 -2.90950213 -1.94125955 2.31722371 Pd 22.38323780 25.26192411 25.46490969 -0.40224884 1.79552332 1.02574376 Pd 23.76260376 23.91324852 24.04530481 6.93408485 3.53429573 -5.96228117 Pd 25.45206007 25.62593290 25.34000708 -1.05110132 -1.61796048 -1.16274454