32 Lattice="54.89596939086914 0.0 0.0 0.0 54.89596939086914 0.0 0.0 0.0 54.89596939086914" Properties=species:S:1:pos:R:3:forces:R:3 energy=-94.46970530364162 stress="0.00012847909462672036 4.088789812300849e-05 -1.9466252100743726e-05 4.088789812300849e-05 8.671392246072816e-05 -0.00013278769667186323 -1.9466252100743726e-05 -0.00013278769667186323 9.804923883694375e-05" pbc="F F F" Pd 27.44764787 27.64018791 27.69460697 0.90149280 -2.64724199 -2.43530344 Pd 29.53947553 29.40057881 27.32871135 -1.12567137 0.34010854 2.12128425 Pd 29.38909180 27.50288043 29.64364036 -2.59463774 0.97867718 -4.59640459 Pd 27.29493759 29.34634037 29.29390711 1.63640482 2.54902594 3.15124749 Pd 31.21448459 27.48445278 27.21508077 1.40379574 0.81878686 2.17780177 Pd 33.49031229 29.24791280 27.24942359 -2.40111275 -0.49660825 1.95849178 Pd 33.22605128 27.35162197 29.60114410 -0.58386110 1.25260869 -1.53180053 Pd 31.36759221 29.41924899 29.57581620 2.03486250 -3.19806987 -2.26362981 Pd 27.30513500 31.49179876 27.75967683 2.19438352 -7.49755336 -8.62656176 Pd 29.37277523 33.55936221 27.20899897 -0.87748470 -1.71852498 1.39031165 Pd 29.58969207 30.98538616 29.57842279 -4.79842991 2.99993762 -3.79244039 Pd 27.27485655 32.91292415 29.40889691 1.63769003 7.50100512 8.64352356 Pd 31.58205242 31.24783056 27.25552276 -0.39560111 -0.81453777 1.26424258 Pd 33.38371817 33.20152954 27.46316288 -0.14219573 -0.66474344 0.40944366 Pd 33.08449091 31.34381890 29.53844014 0.62187890 1.70168324 -1.82060174 Pd 31.28908826 33.18991737 28.96742579 -1.01567805 -0.11838823 1.33021178 Pd 27.54828495 27.41157843 31.51948214 0.44797319 1.14598720 0.83086734 Pd 29.52882721 29.20875080 31.57620655 -1.56646304 1.79671185 0.51852028 Pd 29.48068010 27.43603142 33.49534332 -0.17195122 1.16892481 -1.41944681 Pd 27.53866231 29.51897383 33.41328863 0.94639972 -0.80506721 -0.92274099 Pd 31.17231871 27.32658361 31.18588963 3.71361578 -0.24038032 3.86880248 Pd 33.44279676 29.45681779 31.14735450 -0.72465166 -1.22804319 2.73436144 Pd 33.40054509 27.50301293 33.33547367 -1.12180092 1.28653695 -1.47493343 Pd 31.50663997 29.59672235 33.36936455 0.40336484 -2.97360287 -1.00656095 Pd 27.60534433 31.14339881 31.27078775 0.84067467 0.59555257 1.14726699 Pd 29.39821338 33.54619865 31.34135239 0.41816426 -2.79999270 -0.70392335 Pd 29.63475413 31.28825318 33.41585282 -2.28573384 0.97199787 -1.06469539 Pd 27.84606145 33.42151489 33.34706975 0.13919797 -0.95224068 -0.00690467 Pd 31.15798806 31.35831277 31.32627441 2.97930346 1.06913161 1.73807849 Pd 33.48672150 33.47187320 31.61220710 -0.55592705 -1.73638473 -0.19961118 Pd 33.30355405 31.32438068 33.36178809 0.88708660 0.67854014 -1.67321742 Pd 31.49398362 33.11965726 33.18744117 -0.84508862 1.03616341 0.25432092