32 Lattice="7.402046911543082 0.0 0.0 0.0 7.402046911543082 0.0 0.0 0.0 7.402046911543082" Properties=species:S:1:pos:R:3:forces:R:3 energy=-94.24489763521453 stress="-2.26492438992041 1.0055046462795292 -0.07479323184643594 1.0055046462795292 -2.2234360243773956 -0.31557004503642894 -0.07479323184643594 -0.31557004503642894 -2.381154078949777" pbc="F F F" Pd 0.00071880 -0.02724783 -0.01111086 0.70236599 0.71937392 0.73738598 Pd 1.86185880 1.84155323 0.02857873 -0.47197521 -0.17373141 -0.99036945 Pd 1.85054921 -0.00699304 1.86864101 -0.34291117 -0.82670328 -0.14161387 Pd 0.01533625 1.85374128 1.88131723 -0.92669837 -0.43298726 -0.62195751 Pd 3.69562459 0.04359548 0.04801677 0.12225282 -0.10852253 -0.08603643 Pd 5.54151428 1.88258301 0.01015009 -0.08089581 -0.11499906 0.14590762 Pd 5.55401592 0.01917094 1.84286614 -0.15988644 0.16742958 0.03393579 Pd 3.68944390 1.83711626 1.84467565 0.54125251 -0.35558337 -0.13433408 Pd 0.01062361 3.70655527 0.01833247 0.20393977 -0.03157113 0.18891670 Pd 1.86287774 5.53165872 0.00960317 -0.03053430 -0.13239646 0.09424550 Pd 1.87884157 3.69519065 1.84839736 -0.43472074 0.49246597 -0.49474021 Pd 0.04233598 5.53813181 1.83272159 0.10837046 -0.10952608 0.02587197 Pd 3.73559522 3.71781070 -0.00081819 0.20611198 0.24112478 -0.78911966 Pd 5.58679674 5.56813662 -0.01589233 -0.67536644 -0.69790773 0.69902104 Pd 5.57581008 3.69175768 1.86207531 0.82065547 0.45758829 -0.43458408 Pd 3.71098057 5.55568847 1.84033946 0.40750713 0.80571774 -0.23153998 Pd -0.00680675 0.01129162 3.70176184 0.21288600 0.20724387 0.13968097 Pd 1.81968014 1.87139911 3.72322279 0.25323391 -0.83203049 0.42291307 Pd 1.81421019 0.00182394 5.56316758 0.12614576 0.34334689 -0.32177993 Pd 0.04955035 1.90907839 5.56573978 -0.06088926 -0.23181266 -0.04857900 Pd 3.72084377 0.00126089 3.73020254 0.08250293 -0.53471126 0.23591459 Pd 5.57857320 1.86808343 3.67006781 0.75017275 -0.50854505 0.48080232 Pd 5.54734417 -0.03550998 5.51907377 -0.59098844 0.68758000 -0.60706758 Pd 3.73444885 1.87688616 5.58608754 0.19950606 -0.42127024 0.47633949 Pd 0.03059822 3.67580407 3.66904700 -1.03012873 0.69029930 0.45897313 Pd 1.87372494 5.55333419 3.69010350 -0.21798625 0.65913264 0.41409896 Pd 1.87329377 3.69041999 5.56198928 -0.08582840 0.61248895 0.69904300 Pd -0.00782081 5.54437570 5.52377315 0.68684619 -0.70620404 -0.66275678 Pd 3.73441359 3.67228212 3.66527370 0.08944915 0.61126418 0.74216465 Pd 5.55560642 5.54657098 3.72557122 -0.13869662 -0.02028731 -0.21485451 Pd 5.56741594 3.76064602 5.48791349 -0.07849566 -0.17620977 0.03090462 Pd 3.75278252 5.56503082 5.53512092 -0.18719704 -0.28005697 -0.24678633