32 Lattice="7.842282485961918 0.0 0.0 0.0 7.842282485961918 0.0 0.0 0.0 7.842282485961918" Properties=species:S:1:pos:R:3:forces:R:3 energy=-94.49792615561721 stress="21.255064592822265 6.7135527957098375 -3.2810413015574635 6.7135527957098375 16.779754493421986 -19.14005366899407 -3.2810413015574635 -19.14005366899407 19.499834850062204" pbc="F F F" Pd -0.00033683 0.19220322 0.24662227 0.90153597 -2.64706249 -2.43513044 Pd 2.09149112 1.95259440 -0.11927335 -1.12567566 0.34008341 2.12129425 Pd 1.94110739 0.05489573 2.19565595 -2.59464475 0.97870633 -4.59644287 Pd -0.15304710 1.89835596 1.84592270 1.63639985 2.54884214 3.15104094 Pd 3.76650046 0.03646809 -0.23290392 1.40374257 0.81878337 2.17779948 Pd 6.04232845 1.79992839 -0.19856111 -2.40104463 -0.49659994 1.95844274 Pd 5.77806744 -0.09636272 2.15315969 -0.58383684 1.25262171 -1.53169348 Pd 3.91960809 1.97126458 2.12783179 2.03483856 -3.19800849 -2.26360191 Pd -0.14284970 4.04381464 0.31169214 2.15786323 -5.78375441 -6.63773830 Pd 1.92479083 6.11137837 -0.23898573 -0.87748810 -1.71856851 1.39038853 Pd 2.14170766 3.53740204 2.13043839 -4.79841593 2.99993217 -3.79244420 Pd -0.17312814 5.46494031 1.96091250 1.67420944 5.78726896 6.65464409 Pd 4.13406830 3.79984644 -0.19246193 -0.39564370 -0.81452496 1.26420673 Pd 5.93573433 5.75354570 0.01517819 -0.14221965 -0.66472477 0.40945054 Pd 5.63650707 3.89583477 2.09045573 0.62187593 1.70170975 -1.82062359 Pd 3.84110413 5.74193353 1.51944138 -1.01565890 -0.11838880 1.33018864 Pd 0.10030025 -0.03640627 4.07149802 0.44796775 1.14597960 0.83088833 Pd 2.08084280 1.76076639 4.12822243 -1.56642443 1.79668917 0.51857897 Pd 2.03269569 -0.01195327 6.04735948 -0.17187486 1.16892263 -1.41944903 Pd 0.09067761 2.07098942 5.96530479 0.94640834 -0.80507246 -0.92270166 Pd 3.72433458 -0.12140108 3.73790551 3.71347116 -0.24042718 3.86864773 Pd 5.99481292 2.00883338 3.69937037 -0.72470743 -1.22790395 2.73413354 Pd 5.95256125 0.05502824 5.88748983 -1.12136107 1.28601374 -1.47448116 Pd 4.05865585 2.14873794 5.92138071 0.40314971 -2.97331409 -1.00666119 Pd 0.15735964 3.69541469 3.82280362 0.84066988 0.59559742 1.14726678 Pd 1.95022897 6.09821481 3.89336826 0.41817542 -2.79998515 -0.70392789 Pd 2.18676972 3.84026906 5.96786898 -2.28577482 0.97196954 -1.06461783 Pd 0.39807676 5.97353106 5.89908591 0.13914908 -0.95216331 -0.00690606 Pd 3.71000393 3.91032865 3.87829029 2.97929541 1.06914478 1.73792763 Pd 6.03873766 6.02388936 4.16422297 -0.55594914 -1.73645122 -0.19952243 Pd 5.85557021 3.87639656 5.91380425 0.88706236 0.67850414 -1.67328488 Pd 4.04599950 5.67167342 5.73945733 -0.84509477 1.03618087 0.25432801