32 Lattice="7.509835645256625 0.0 0.0 0.0 7.509835645256625 0.0 0.0 0.0 7.509835645256625" Properties=species:S:1:pos:R:3:forces:R:3 energy=-107.66917144726521 stress="-0.021490279674377787 -0.0005198607760374985 -0.002436656950040086 -0.0005198607760374985 -0.02039873740174873 0.0006050674614379973 -0.002436656950040086 0.0006050674614379973 -0.02065842271458654" pbc="F F F" Pd 0.00163883 0.03248545 0.00464645 0.66261324 0.62207377 0.62993755 Pd 1.90907328 1.90143973 0.01908746 -0.56680412 -0.57416049 -0.90004146 Pd 1.89053596 0.02743185 1.89391459 -0.58668453 -1.14037123 -0.72082542 Pd 0.03403441 1.88629292 1.87663804 -1.08051251 -0.38429382 -0.61163764 Pd 3.74185767 0.00621769 0.06034015 0.17906028 -0.09646715 -0.34106651 Pd 5.63330882 1.90196350 0.03411891 0.06669413 -0.28483017 -0.30191958 Pd 5.62615867 0.03677674 1.81711543 0.19704405 -0.27434694 0.15895264 Pd 3.76518387 1.85105387 1.91088794 0.22978563 0.24564946 -0.50065867 Pd 0.03869870 3.80142169 0.03914623 -0.13613527 0.09287134 -0.10546353 Pd 1.88643194 5.63192634 0.02656246 -0.21305326 -0.02291842 0.00091267 Pd 1.86945864 3.72616643 1.88165185 -0.04899394 0.76210715 0.01224319 Pd 0.02305248 5.62809317 1.91929422 0.20187361 -0.10015220 -0.08098769 Pd 3.76804625 3.73757214 0.01899060 0.18349198 0.45360673 -0.92033071 Pd 5.60144190 5.63649779 0.01819479 -0.49127275 -0.52641975 0.49406862 Pd 5.60284002 3.73297975 1.85534576 0.88201707 0.62141209 0.09616113 Pd 3.73301177 5.59775851 1.85468107 0.43416217 0.88396647 -0.06238431 Pd 0.02395526 0.05017592 3.72132621 -0.32209652 -0.20465975 0.33361619 Pd 1.89743953 1.84964649 3.72767687 -0.37516011 0.38149979 0.81118328 Pd 1.85467777 0.02537066 5.58327270 -0.10370876 -0.21219217 0.28194362 Pd 0.03886982 1.88181020 5.66730806 -0.11600513 -0.22469802 -0.12687057 Pd 3.73141965 0.01108451 3.75695811 0.83432554 -0.96640758 0.57250651 Pd 5.62423542 1.85136858 3.73304434 0.61194780 -0.19475923 0.76030834 Pd 5.63360685 0.00348436 5.61906944 -0.67996922 0.68006658 -0.63333093 Pd 3.73120778 1.87847623 5.66907196 0.63700959 -0.35706406 0.37375700 Pd 0.00495603 3.72855237 3.77133781 -0.64638056 0.47195356 0.27236905 Pd 1.91223313 5.62625322 3.82560768 -0.65007592 0.75499889 -0.14576005 Pd 1.85060039 3.72739713 5.62583425 -0.11627253 0.44032969 0.85941123 Pd 0.03663006 5.63960847 5.61508132 0.41638975 -0.50458584 -0.44871302 Pd 3.73641820 3.78315778 3.77977722 0.60848216 -0.17654383 0.23579119 Pd 5.60931538 5.62031355 3.75394099 -0.14407187 -0.15640092 0.17569286 Pd 5.63141817 3.73664033 5.61524957 -0.21179117 0.19054163 -0.19011417 Pd 3.74948498 5.63991897 5.64658524 0.34409114 -0.19980556 0.02124919