32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=1234.12237438 pbc="F F F" Pd -0.03086289 -0.01705624 0.01464345 46 -10.21359911 -10.74325246 -19.68889412 Pd 1.93912990 1.39156697 0.28794390 46 -129.28035650 91.62554301 -169.50467164 Pd 1.57907961 0.21881692 1.44599977 46 -68.75800932 -260.09786701 89.27302431 Pd -0.26527182 1.23241985 1.75424184 46 -97.24258187 305.76890707 -312.24907717 Pd 3.15238676 0.05098485 0.12287396 46 -114.03788475 -215.07937752 -104.83497995 Pd 4.30454100 1.34706055 0.07540318 46 154.11395598 131.41480637 -73.53076703 Pd 4.45297513 -0.01874568 1.36894099 46 105.50354974 -69.98597239 117.27351414 Pd 3.11454909 1.47363823 1.96880042 46 -20.93290232 -171.89094400 -433.65703525 Pd 0.14354830 2.88100308 0.03966999 46 -19.64616564 -35.11793461 -34.06597183 Pd 1.64329646 4.26505378 0.47603759 46 -1409.53724509 -568.48114656 -1166.17691452 Pd 1.78650411 2.85263676 1.68998123 46 -75.31779977 46.26714799 -87.26232611 Pd 0.01036284 4.38323780 1.34544783 46 -88.51473241 43.47257267 42.78780425 Pd 2.96490969 2.76260376 -0.03360673 46 65.23074961 137.19564601 -89.81475262 Pd 4.31351044 4.40409742 0.38704437 46 77.95207189 78.72697675 -94.05633812 Pd 4.34000708 2.89901191 1.41812645 46 98.92759712 -16.59554688 -12.84673505 Pd 2.70122014 4.73212867 1.25294705 46 1413.39530108 690.93367724 1110.88543731 Pd -0.01699667 0.15798483 2.91251877 46 0.94308949 -312.76264307 271.79937842 Pd 1.66587486 1.45283623 2.78353165 46 -256.21774963 -11.49550967 268.07640753 Pd 1.20072959 0.15085428 4.34628414 46 28.64105448 -15.91709449 80.59178582 Pd -0.20972787 2.02159337 4.21156333 46 -153.97642978 -300.92343700 249.31271044 Pd 2.91738082 -0.06047329 3.14803915 46 9.20565999 -81.68331660 11.61971589 Pd 4.26416454 1.82148139 3.03806039 46 598.53182920 -263.07121136 165.71880903 Pd 4.28832765 0.30522403 4.55607448 46 45.64054398 -37.97192261 35.44055691 Pd 3.17677645 1.93873293 4.49509235 46 -719.17077061 -515.19420090 120.31965074 Pd 0.13066371 3.18686274 3.13391685 46 -249.96093085 82.58984666 -315.97432431 Pd 1.42588762 4.21223271 3.02295220 46 207.90033585 284.27115054 -40.56008188 Pd 1.40411058 2.93800533 4.37252202 46 128.54737405 -23.40542536 162.94398982 Pd -0.19692910 4.44057204 4.70040666 46 -14.58705484 26.67974650 26.88999051 Pd 3.18883224 3.03502127 2.90925737 46 -239.27974542 353.90548093 36.64084119 Pd 4.46427615 4.53803524 2.95791550 46 70.01936238 42.00561307 -35.84287416 Pd 4.36745644 2.86266044 4.52015931 46 700.52046757 555.53976823 135.51750071 Pd 3.11211101 4.53310309 4.31305510 46 -38.39898451 40.01991945 64.97462673