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=11928.359487395039 stress="-52314.72783070037 -6929.153212284118 -7423.78083956222 -6929.153212284118 -54693.14996763525 -9790.484316878534 -7423.78083956222 -9790.484316878534 -50946.44249178176" pbc="F F F" Pd 0.00540600 0.17572591 -0.03328662 -41.90329771 -46.84628031 -105.74591007 Pd 1.93918290 1.89949114 0.23046060 -2454.34432592 -2779.60854744 -1135.78223040 Pd 1.44846850 -0.01235804 1.69564496 2723.55339704 68.53075522 -2586.20020844 Pd 0.06391899 1.56956008 1.70288447 -3378.78761548 -2856.92161400 -255.17525090 Pd 2.98632550 -0.12956137 -0.08899392 -60.25391129 -131.60258756 -102.65746812 Pd 4.58224886 1.37976163 -0.06464986 270.54857920 -148.72568399 -100.51061502 Pd 4.28274383 0.01285184 1.78388123 1173.66557311 -962.63892561 -578.65150367 Pd 2.95130915 1.30948353 1.73449751 -41.33959197 1148.31516519 -414.21545329 Pd 0.31284871 2.81591586 -0.18971891 -731.32694820 196.04948153 -314.80537334 Pd 1.42058324 4.59127555 -0.25790858 97.86921286 167.25313089 -25.56481768 Pd 1.23725104 2.75092727 1.73550005 2917.71106481 3658.73246476 -429.81476252 Pd 0.02087968 4.59548523 1.78182057 -5060.43045634 1059.51468703 -4666.30192805 Pd 3.27858419 2.92046090 0.20479410 1062.83208174 1485.73543656 -1394.65190445 Pd 4.32517541 4.47993581 0.16350831 608.35145460 1628.38076830 -1247.01567981 Pd 4.52680967 3.19300718 1.43855626 1591.29202042 -2506.54128419 -381.65036603 Pd 3.01364829 4.58842266 1.64925482 -580.70754758 518.62962325 11.60885901 Pd 0.15923894 -0.22804708 2.75068014 -3106.92187914 -735.18138155 2427.54885767 Pd 1.49534487 1.68048428 3.23777287 -2919.53331068 -8220.59070662 -7069.65311624 Pd 1.60346548 -0.21288825 4.33671884 -852.77699693 -392.22961378 1053.11343924 Pd -0.04839549 1.22274478 4.50485515 -296.31743856 -31.22894876 240.66422648 Pd 2.93388826 0.09286149 3.13822228 -1573.95227982 -1441.40323701 -1811.26029863 Pd 4.62094259 1.51814745 3.10925593 1552.02309253 1492.11227863 -1976.46636332 Pd 4.21708594 0.27588069 4.25930314 2065.67352203 -1892.81725181 3648.70652058 Pd 2.98661354 1.75519996 4.09180611 318.95322481 -3802.67089291 2211.40989949 Pd 0.10882905 3.13202009 3.29509943 -3184.33352419 -6225.06403153 -3203.85876212 Pd 1.20369121 4.39052559 2.85715748 7308.13899907 1594.54748437 3135.69357909 Pd 1.63538602 2.86304167 4.25345778 121.92008824 8472.71948378 7631.15275650 Pd 0.06147043 4.40524783 4.30616908 -927.24527422 4790.05519818 4634.52614787 Pd 3.25260190 3.04513816 2.93740500 -674.44447501 -487.82195436 -3712.55460053 Pd 4.71841033 4.26218281 2.77112022 1186.95735065 2221.50622553 2128.50124332 Pd 4.26546435 2.72705083 4.63626708 5135.53582665 -1326.02784096 2623.04291068 Pd 3.33796162 4.07153743 4.30331630 -2250.40661473 5485.83859916 1766.56817274