64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=24.150322000618527 stress="-0.001747355943356168 -0.0001296134658263584 -0.0007094501612665601 -0.0001296134658263584 -0.001693958372213554 0.0001113681583297852 -0.0007094501612665601 0.0001113681583297852 -0.0013804184036217736" pbc="F F F" Pd 35.22086729 34.98310996 34.77096654 -5.73877424 -5.96761677 -7.16088958 Pd 36.15142137 35.93572417 35.98055861 -5.32242552 -18.76645310 20.45336120 Pd 36.67756578 37.22516294 35.23402360 8.70845746 23.91887140 -14.96608599 Pd 38.60714772 38.38846909 36.18004449 -11.58906995 3.63655933 -19.53576865 Pd 37.66099888 35.43120791 38.14671993 -61.09118494 -25.73756196 -38.53526725 Pd 38.78275119 35.88656467 38.85899891 56.17397082 28.79573030 28.84978009 Pd 34.86273032 37.66171571 38.07174639 -1.62489263 -1.52315640 -1.04001953 Pd 36.55604684 39.07636534 38.99475015 -37.86467979 87.70407285 -51.09781639 Pd 40.05873752 35.10223056 35.25284888 -0.10297689 0.58270600 -0.08351325 Pd 41.57116719 36.00454661 36.78983070 -7.24161296 1.55962506 -9.01646014 Pd 42.51432400 36.93324962 34.69615509 -0.51784882 -0.05917813 0.38205117 Pd 43.42712388 38.91385061 36.22088890 9.68112030 -12.13991576 -7.86374434 Pd 42.73578848 35.79150318 38.24752218 -59.56750754 -30.38148952 -20.57705466 Pd 43.94092265 36.28827392 38.75986480 70.50947015 23.37232966 24.57931379 Pd 39.59592731 38.07886991 37.48008817 -0.09401801 -8.97023473 -2.07286920 Pd 40.62053955 38.32819731 38.74879789 15.19854846 3.22921090 18.62565177 Pd 34.82624793 39.49365118 35.42673195 -7.21968162 -7.07737566 -6.26715958 Pd 35.82447290 40.48365875 36.32972720 5.89221445 7.54563820 5.41050362 Pd 37.04272155 42.62085647 34.71585688 -0.85252161 -0.92928297 -0.07511076 Pd 38.61643991 43.32327578 36.40123177 -50.64372578 32.07640788 -34.25472469 Pd 37.95366604 40.22421110 37.71888199 -63.14829645 -25.05115329 -23.14025148 Pd 39.18297782 40.79320854 38.10604617 65.49090231 26.52310756 23.31671135 Pd 35.55144207 42.98718444 37.56749592 -0.44497056 -0.67785887 -2.52079902 Pd 36.36908973 43.18551945 39.48051560 -4.30421193 8.26894374 -3.05286628 Pd 40.02960540 40.64290765 34.70374204 -0.69407947 0.25691908 0.37939955 Pd 42.02950833 41.12475624 36.22392148 -23.41693931 60.12965673 -50.22203015 Pd 42.12348886 43.07934823 34.84716767 -0.46354557 0.98382111 -0.83121492 Pd 43.48230473 43.41110275 36.62701071 -0.16158667 -0.04993571 0.63849071 Pd 42.42080033 40.09122498 37.07979447 10.98560851 -53.43603779 54.06467475 Pd 43.52852024 41.29193439 38.47251254 9.15931075 -1.98054976 0.85826732 Pd 39.66448343 42.68403127 37.11226018 52.30278374 -25.06386282 30.75947306 Pd 40.97555741 43.73320924 39.13407115 -4.05941736 4.54204862 0.35419090 Pd 34.65654452 35.45747797 39.97069233 0.03349609 0.40146937 -0.55956463 Pd 36.50657936 36.42435429 41.02401715 -1.38236420 -0.88055222 0.80028745 Pd 37.00297454 37.99791377 39.62151619 38.39574681 -87.83177764 49.96565728 Pd 38.77234072 38.68613018 41.43796857 -3.98441687 -12.11671317 4.49129936 Pd 36.83462511 35.19609263 42.46322326 -0.41215931 -3.13232980 2.20437503 Pd 38.64096164 35.89741475 43.69480924 -2.30211390 -1.83804989 1.88201950 Pd 35.00811505 38.24481653 42.89302117 -16.88514869 -15.36141895 -10.04473520 Pd 36.10532765 39.23422129 43.54655608 0.20500914 5.78380045 21.44484325 Pd 39.53100435 35.07327613 40.32427134 3.68112479 -6.28972451 10.21610662 Pd 41.48837336 36.00831489 41.43404765 -20.32670529 35.09157822 -18.75718340 Pd 42.84911873 37.69155341 40.03246593 -14.58388537 -11.38500885 -21.55884784 Pd 43.44382035 38.49425818 41.20966815 14.19208990 16.74176445 25.48126777 Pd 42.20384740 34.85081933 42.03810700 21.97314487 -37.02256644 18.52813652 Pd 43.83127293 35.71206028 43.58587175 0.27858105 0.64867391 0.27375101 Pd 40.07818382 36.91839384 43.08790297 1.83165816 3.17636513 0.33661369 Pd 41.22478383 39.21689787 43.75234525 -2.84179847 -2.16366808 3.00404345 Pd 34.74337686 39.85362037 40.18467774 -11.68803481 -14.97653746 -1.46611862 Pd 35.46691157 41.32905582 40.50773197 5.09692858 10.37947172 0.84130878 Pd 37.64811637 42.01817168 40.27161489 4.28800363 -12.09293079 -2.95013573 Pd 38.34608634 43.28337470 41.31175621 3.11445411 9.30518265 6.98529200 Pd 37.36102597 39.94186987 42.67104226 11.61064547 9.35438582 -10.58806765 Pd 38.94369432 41.26792070 43.37416104 -1.63747799 -0.06733913 4.97986588 Pd 34.82758830 42.35295238 42.05413934 -0.99846886 3.31928760 4.87673170 Pd 36.70834461 43.95484767 43.58445220 0.11901293 -1.01502779 -1.06377358 Pd 39.70549175 40.04527080 40.72110304 -10.12615640 -8.32250998 -10.84492950 Pd 40.89974943 41.22892384 41.12165250 38.63037436 -24.19421724 -46.19567724 Pd 42.34497277 42.45681557 39.26778844 0.02083835 2.09285319 3.71610770 Pd 43.64260964 43.84306647 41.60697114 -1.09038977 -1.16314019 0.58944568 Pd 42.26459378 40.20201412 42.51948547 5.72777572 1.25958971 1.21158422 Pd 43.87725473 41.77735174 43.86983378 -1.19447517 0.74580996 -0.87410732 Pd 40.39757659 42.11536967 42.13716159 -18.71433945 46.96954904 47.30699713 Pd 41.49947850 43.65939049 43.93558996 1.03063123 -0.73025429 -0.59081675