32 Lattice="7.780000305175786 0.0 0.0 0.0 7.780000305175786 0.0 0.0 0.0 7.780000305175786" Properties=species:S:1:pos:R:3:forces:R:3 energy=-87.82434908132844 stress="30.832018676066205 1.868325592137075 -2.2431567328113937 1.868325592137075 27.36217166150707 -1.9326655056000699 -2.2431567328113937 -1.9326655056000699 28.934382971224125" pbc="F F F" Pd -0.12049575 0.09262900 0.09204096 1.09343008 0.62089000 0.73379870 Pd 2.11966816 1.78786216 -0.13472070 -0.52128850 0.37859518 1.32952763 Pd 1.79665653 -0.13741853 2.06201188 0.12978093 1.09027447 -0.31119553 Pd -0.18489349 1.98231525 1.57136759 1.30403663 0.16882492 0.54376423 Pd 3.75712383 -0.03420984 0.16882826 0.03588038 0.77135882 0.66142008 Pd 5.88920130 1.62374580 -0.11208157 -1.32739750 0.31050282 1.22128353 Pd 5.45468635 0.18564236 2.09986988 0.73113719 -1.24596919 -1.72264556 Pd 4.04302357 2.10818275 2.06737515 -1.83724433 -1.20733357 -0.83129393 Pd 0.22466171 4.03688543 -0.12164601 0.94012458 -0.45452434 0.83071723 Pd 2.11996958 5.82839298 -0.12101080 -0.30899406 -0.88401712 0.95733000 Pd 1.97706938 3.85478898 2.12605828 -1.23413394 -0.37201344 -1.17379562 Pd -0.03508886 5.74188091 1.56443820 1.16689932 -0.84664896 0.37551439 Pd 4.04982197 4.03912947 0.24284059 -0.90478604 -0.76563929 -1.75879136 Pd 5.93046155 5.86211341 0.12420575 -0.94428719 -0.72421103 0.82626351 Pd 5.65242711 3.87916249 1.91670005 2.20984899 0.58473740 0.56098167 Pd 3.72831703 5.68631354 1.95634673 0.56353486 1.35492457 0.10368369 Pd -0.12334412 -0.02027049 3.82722170 0.81169904 1.04496123 -0.09828038 Pd 1.94150821 1.76039056 3.88542872 -0.36605795 0.29171528 0.37191991 Pd 1.60143721 -0.13216084 5.68223470 0.33972580 0.95363533 -0.80703592 Pd -0.06678005 1.71658322 5.91061611 1.14056692 0.22844090 -1.25970370 Pd 4.11683317 -0.05515562 3.99944115 -1.15136266 0.74979859 1.17425310 Pd 6.05148914 1.71660435 3.71087293 -0.22132773 1.17338257 1.59213081 Pd 5.98804787 0.16907269 5.90452799 -1.05455661 0.93032332 -1.06965878 Pd 3.65322739 2.06899722 6.01912099 0.15895315 -0.11422986 -1.39642028 Pd -0.05404580 4.04158621 3.74152930 0.78804222 -0.23821299 0.21896537 Pd 2.12182719 5.77237835 3.99825570 -1.04516325 0.15096357 -0.21730424 Pd 1.76350383 4.12565180 5.88675023 0.05933036 -1.50660072 -0.53943456 Pd 0.02873354 5.68913763 5.89362048 0.39975992 -0.33293769 -0.85228125 Pd 3.93043743 3.93561264 3.81967572 -0.04234944 -0.52304138 1.53720691 Pd 5.94884702 5.75566717 4.02255634 -1.10787156 -0.59258063 -0.43413938 Pd 5.66724195 3.98201579 5.64113032 -0.28144737 -0.77968510 -0.17542896 Pd 3.75277886 5.61957219 5.90676363 0.47551775 -0.21568368 -0.39135128