32 Lattice="7.842281341552734 0.0 0.0 0.0 7.842281341552734 0.0 0.0 0.0 7.842281341552734" Properties=species:S:1:pos:R:3:forces:R:3 energy=-94.46970530364159 stress="21.254644389633768 6.764195661317842 -3.2203547760230276 6.764195661317842 14.345318908791135 -21.967428088429497 -3.2203547760230276 -21.967428088429497 16.22055097919444" pbc="F F F" Pd -0.00033683 0.19220322 0.24662227 0.90149280 -2.64724199 -2.43530344 Pd 2.09149083 1.95259412 -0.11927335 -1.12567137 0.34010854 2.12128425 Pd 1.94110711 0.05489573 2.19565566 -2.59463774 0.97867718 -4.59640459 Pd -0.15304710 1.89835568 1.84592242 1.63640482 2.54902594 3.15124749 Pd 3.76649989 0.03646809 -0.23290392 1.40379574 0.81878686 2.17780177 Pd 6.04232759 1.79992810 -0.19856111 -2.40111275 -0.49660825 1.95849178 Pd 5.77806658 -0.09636272 2.15315941 -0.58386110 1.25260869 -1.53180053 Pd 3.91960752 1.97126430 2.12783151 2.03486250 -3.19806987 -2.26362981 Pd -0.14284970 4.04381407 0.31169214 2.19438352 -7.49755336 -8.62656176 Pd 1.92479054 6.11137751 -0.23898573 -0.87748470 -1.71852498 1.39031165 Pd 2.14170737 3.53740147 2.13043810 -4.79842991 2.99993762 -3.79244039 Pd -0.17312814 5.46493945 1.96091221 1.63769003 7.50100512 8.64352356 Pd 4.13406773 3.79984587 -0.19246193 -0.39560111 -0.81453777 1.26424258 Pd 5.93573348 5.75354484 0.01517819 -0.14219573 -0.66474344 0.40944366 Pd 5.63650621 3.89583420 2.09045544 0.62187890 1.70168324 -1.82060174 Pd 3.84110356 5.74193267 1.51944109 -1.01567805 -0.11838823 1.33021178 Pd 0.10030025 -0.03640627 4.07149744 0.44797319 1.14598720 0.83086734 Pd 2.08084251 1.76076610 4.12822186 -1.56646304 1.79671185 0.51852028 Pd 2.03269540 -0.01195327 6.04735863 -0.17195122 1.16892481 -1.41944681 Pd 0.09067761 2.07098914 5.96530394 0.94639972 -0.80506721 -0.92274099 Pd 3.72433401 -0.12140108 3.73790493 3.71361578 -0.24038032 3.86880248 Pd 5.99481206 2.00883309 3.69936980 -0.72465166 -1.22804319 2.73436144 Pd 5.95256040 0.05502824 5.88748897 -1.12180092 1.28653695 -1.47493343 Pd 4.05865528 2.14873765 5.92137986 0.40336484 -2.97360287 -1.00656095 Pd 0.15735964 3.69541411 3.82280305 0.84067467 0.59555257 1.14726699 Pd 1.95022869 6.09821396 3.89336769 0.41816426 -2.79999270 -0.70392335 Pd 2.18676943 3.84026849 5.96786812 -2.28573384 0.97199787 -1.06469539 Pd 0.39807676 5.97353020 5.89908505 0.13919797 -0.95224068 -0.00690467 Pd 3.71000336 3.91032808 3.87828972 2.97930346 1.06913161 1.73807849 Pd 6.03873681 6.02388851 4.16422240 -0.55592705 -1.73638473 -0.19961118 Pd 5.85556936 3.87639598 5.91380339 0.88708660 0.67854014 -1.67321742 Pd 4.04599893 5.67167256 5.73945647 -0.84508862 1.03616341 0.25432092