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:forces:R:3 energy=251.74218738680682 stress="-1017.0963113336377 73.6778816246881 -117.75179769966661 73.6778816246881 -974.3757711943226 -58.6674994935031 -117.75179769966661 -58.6674994935031 -1080.9425883631911" pbc="F F F" Pd -0.11090311 0.11115480 0.11044915 -10.64295155 -26.39750772 -27.75363036 Pd 1.70960170 1.31143450 -0.16166483 -20.96257740 28.43865894 -13.60102888 Pd 1.28829595 -0.16490224 1.66640352 11.11252058 -30.30485547 -17.84994316 Pd -0.22187219 1.51878885 1.32834452 -17.14815661 13.34879222 16.31422402 Pd 2.87679405 -0.04105180 -0.07410960 17.67767424 -42.07078181 -3.95547082 Pd 4.56504129 1.17241380 -0.13449789 15.45080203 9.87491518 -14.92198102 Pd 4.28802619 0.22277084 1.68584377 9.26479245 -87.91981804 -89.38661837 Pd 3.18362810 1.69581920 1.55268552 -30.82135456 -22.27030668 -15.12414437 Pd 0.26959405 3.17626233 -0.14597521 -54.18774570 -14.24615813 -81.34679288 Pd 1.70996341 4.49207130 0.15300231 -11.12119072 49.93328190 -53.32354389 Pd 1.29408032 2.95774659 1.12030630 59.05625342 -42.42965430 44.28834673 Pd -0.04210664 4.38825682 1.27041603 -32.37993134 57.02233807 -2.58219443 Pd 3.19178619 3.17895518 0.29140871 -37.32341771 -36.43978717 -107.86140059 Pd 4.61455359 4.53253581 0.14904689 19.43656184 25.95705669 -16.13063829 Pd 4.28091226 3.10609294 1.46603997 100.25341138 -12.30493572 37.54115159 Pd 2.80598025 4.32157598 1.51361598 8.01545476 61.72009683 42.45866069 Pd -0.14801295 -0.02432459 3.06329927 -32.04094186 -13.69667222 -13.99111110 Pd 1.73620268 1.27846858 2.76742400 -14.56636802 26.44250717 16.03165460 Pd 1.34126820 -0.15859300 4.31668137 17.99814070 -25.21378692 19.03460119 Pd -0.08013605 1.24396547 4.59073906 -12.61053213 22.60098273 17.18525704 Pd 3.27219963 -0.06618674 3.13132919 -30.19909999 -28.77178900 23.43777676 Pd 4.75978669 1.22592512 2.78504734 53.12071464 75.73140825 69.66193534 Pd 4.68365717 0.08378910 4.58343331 11.16372268 -4.42418376 17.95596216 Pd 2.65722062 1.50644989 4.72094491 6.49790519 3.41679774 13.04492719 Pd 0.23171545 3.18190327 2.56829135 -25.37826314 -25.96926639 52.02871042 Pd 1.71219253 4.42485375 3.12990665 -20.02059866 44.12729678 -27.96763784 Pd 1.28220450 3.28278197 4.56210000 46.05002820 -102.85954677 22.71141574 Pd 0.13362859 4.32702941 4.57034430 -88.17875431 75.55985101 8.95844013 Pd 3.04852473 3.05473499 2.91561068 -22.76459393 -25.10834433 10.48484437 Pd 4.63661615 4.40480033 2.85912935 19.68350113 35.58842689 0.11413855 Pd 4.29869006 3.11041876 4.26735611 41.82074844 -28.03163697 34.57978621 Pd 2.83533445 4.24148635 4.58611608 23.74424595 38.69662098 39.96430328