64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=526.785240967 pbc="F F F" Pd -0.39135657 -0.24455350 0.45620862 46 1.32797402 1.16934296 1.08486195 Pd 1.37538137 1.75732051 1.94726128 46 -10.85509863 24.25021271 -20.96417128 Pd 3.11451290 2.46956857 0.11650322 46 -24.34903284 -15.19678211 -11.64008210 Pd 4.60049286 3.39020384 0.79288221 46 27.84723259 -5.88146222 22.73933548 Pd 2.56016553 0.43006567 1.96574193 46 31.10555456 -35.12250628 0.48569893 Pd 3.76573397 0.57313258 4.42686472 46 -377.66446586 220.65501444 17.52696810 Pd 0.08760360 2.35283044 3.17016586 46 -24.76508774 4.30244916 15.86635334 Pd 1.00230605 3.82375827 4.45958860 46 49.48367039 -127.38676247 26.64570427 Pd 4.94832261 -0.15466873 -0.01486838 46 -10.08114332 -6.34590279 -6.77438011 Pd 6.41128002 0.82410439 1.00933766 46 9.18901453 6.40478231 7.23795015 Pd 7.22959710 2.76075590 -0.36579075 46 -4.57404404 -1.16672147 -4.90128270 Pd 8.70161237 3.38703266 1.06473968 46 4.28097608 2.03004105 4.90241199 Pd 7.75884290 -0.09257921 3.06341885 46 -53.63752550 -38.25048191 -23.49994180 Pd 9.04791795 0.82611144 3.64345295 46 53.48929553 38.38222629 24.12254869 Pd 4.79423121 2.32468448 2.95325902 46 -8.42915056 -6.76150268 -0.22575552 Pd 6.47764194 3.52324877 3.31794541 46 -24.02246052 -68.27540247 1.41722367 Pd 0.77987174 4.72855713 0.33921175 46 -11.78542792 -26.26092117 -22.54550996 Pd 1.38264645 6.03707952 1.47822501 46 0.19697190 20.60905851 17.85226675 Pd 2.34856997 7.65185138 0.72671082 46 6.61765266 11.52487547 -5.43302873 Pd 4.24514229 9.14920249 1.06391496 46 0.91905481 0.57841509 0.05831491 Pd 2.14046443 4.93989801 3.04639830 46 18.18684118 -3.74465673 -1.49338962 Pd 4.61653020 6.36075317 3.80439579 46 11.61006431 -65.60114261 19.14631120 Pd 0.03543728 7.82727779 2.73378008 46 -14.87479767 -10.46334962 -5.53833528 Pd 1.54921662 8.94342600 3.35001239 46 10.19157585 12.98636207 3.60912092 Pd 4.38202560 5.02272029 -0.18326267 46 -2.96352619 22.28217289 -12.97955040 Pd 6.66123572 6.27352808 1.94132955 46 -12.18981767 -13.54492869 16.15477710 Pd 6.89909580 7.38563920 0.56536751 46 6.92512265 29.55191041 -35.04931171 Pd 8.84720328 9.07299061 0.69090318 46 -1.22430552 -1.05550163 0.03545080 Pd 7.13905036 5.02210201 3.30438886 46 32.86151539 55.66385655 15.64132806 Pd 9.07562880 5.80630790 3.85300141 46 6.25639610 2.26496383 1.65867841 Pd 4.43121802 7.79624792 3.11493454 46 56.74314843 54.77012059 -131.15904996 Pd 6.29206909 8.21353373 3.37665770 46 7.57127517 13.68156010 -13.68281774 Pd -0.15623251 0.17153128 4.66586119 46 0.41913160 0.61078587 -0.04281070 Pd 1.13861596 1.46547028 6.38208999 46 58.68903547 -49.98761084 -131.95129719 Pd 2.80481537 2.37593653 5.48841430 46 4.50620601 0.32723116 -7.26306230 Pd 3.39269394 4.10374923 6.62602727 46 247.48092241 -100.36166085 -175.68552698 Pd 2.92368074 -0.16691336 7.23221632 46 0.04126966 0.06069683 -0.99491987 Pd 3.84125302 0.95034668 9.06333348 46 0.27959251 0.64186469 0.07795275 Pd 0.50955283 1.86819863 7.63290095 46 -131.46060418 -94.05079652 104.66555115 Pd 1.12257553 3.16400276 7.90203469 46 54.83532106 129.25351968 35.25633302 Pd 4.77846415 -0.02451634 4.37860536 46 377.86108415 -223.51143876 -19.02071720 Pd 6.19484932 0.79098087 6.19209497 46 -17.01774993 -31.52712334 15.05319656 Pd 7.13075120 2.15361224 5.40538315 46 16.83568125 19.66666152 -17.91267709 Pd 7.86673929 4.12947574 5.84777460 46 14.50212101 -13.75252044 -16.84773191 Pd 7.90200530 0.57408847 8.05304459 46 -28.72658655 -48.42617842 -49.25744164 Pd 8.55089024 1.64325708 9.15581353 46 29.29507139 48.55830546 49.88652354 Pd 4.90699807 2.56025093 6.81295444 46 2.44885161 -0.80493023 2.93243831 Pd 6.46278757 4.27843074 8.52007438 46 -3.94451241 -6.40894965 8.52646179 Pd 0.44765731 5.20836147 4.29103973 46 -59.24554375 129.79069184 -9.91906794 Pd 1.22126391 6.40551249 6.55920407 46 120.53874340 -229.88587994 -377.00901868 Pd 3.38691629 8.00841698 4.18598345 46 -89.96360987 23.60871986 94.85602165 Pd 4.29288788 8.93577315 6.65763015 46 -28.10053661 93.92187888 -70.43699982 Pd 2.42977205 4.52610692 7.31643753 46 -241.80933574 118.63774743 175.12589561 Pd 3.71804465 6.22199930 8.43282652 46 -7.68451274 -12.46298107 8.35019014 Pd 0.91485847 6.99074047 7.51435328 46 -111.18003719 193.41987862 339.64475993 Pd 0.61939706 8.18322405 8.70672931 46 -9.02165734 36.75410754 36.75698511 Pd 4.89533878 4.88167553 4.95145512 46 4.99636585 -20.91755046 15.74520257 Pd 6.38171431 6.72876454 6.38784978 46 -46.06962163 66.58315070 -27.03318592 Pd 7.47110568 7.67102064 4.81665308 46 18.95425653 -2.33684789 11.03458661 Pd 8.56060227 9.10581023 7.16839304 46 -1.24948781 -1.18358820 0.56959740 Pd 7.16350488 5.44573536 6.96780538 46 36.01860087 -43.13301575 42.37551355 Pd 8.22911180 6.76997912 8.91133019 46 -0.82489938 0.64533853 -1.06793580 Pd 4.65324564 7.73665619 7.55449370 46 32.56363752 -80.19142069 63.11423099 Pd 6.46125331 8.80187083 8.61743915 46 2.64535064 0.41257488 0.17225455