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=141.98386501044436 stress="-765.1221526872617 27.05342108374616 -40.07147493087325 27.05342108374616 -762.3461888099448 -22.277108144466524 -40.07147493087325 -22.277108144466524 -782.7240541254224" pbc="F F F" Pd -0.14459490 0.11115480 0.11044915 -12.20947138 -24.50380936 -28.26044122 Pd 1.74329349 1.33742386 -0.16166483 -8.23368770 14.66585816 -21.46225161 Pd 1.01159245 -0.16490224 1.60416852 12.92108084 -21.59520075 -0.09338821 Pd -0.22187219 1.42462428 1.08394168 -18.20263043 22.54920627 14.27021718 Pd 2.57857878 -0.04105180 0.20259391 15.22807392 -28.35611787 -5.15447127 Pd 4.56504129 1.50740770 -0.13449789 9.19502563 -4.75402506 -13.33573798 Pd 4.28802619 0.22277084 1.68584377 14.55498263 -47.01177674 -42.79389165 Pd 3.18362810 1.69581920 1.64685009 -32.34480421 -28.89955389 -2.59801741 Pd 0.26959405 3.17626233 -0.14597521 -20.05657705 -9.71729072 -31.74506678 Pd 1.70996341 4.49207130 0.15300231 -6.93640368 36.18330923 -35.48903076 Pd 1.53848316 2.95774659 1.19143129 -15.64800348 -24.58643061 17.18848799 Pd -0.04210664 4.38825682 1.15131790 -20.40369465 21.69122853 9.65076972 Pd 3.19178619 3.17895518 0.29140871 -4.14237685 -12.23311801 -70.12145714 Pd 4.61455359 4.53253581 0.14904689 12.83773697 13.85693626 -8.53630139 Pd 4.28091226 2.96745953 1.46603997 70.26894702 10.77048325 14.34645803 Pd 2.80598025 4.32157598 1.51361598 12.98091722 53.67138568 20.77147075 Pd -0.14801295 -0.02432459 3.12165461 -33.35259900 -18.72659677 -4.50625478 Pd 1.18391079 1.27846858 2.97644859 13.43628084 17.70147175 -7.48345912 Pd 1.26128685 -0.15859300 4.31668137 10.81088418 -25.86043905 18.42750710 Pd -0.08013605 1.24396547 4.59073906 -15.53316087 11.84122385 18.21851322 Pd 3.27219963 -0.06618674 3.13132919 -17.66659009 -20.67938923 13.76557554 Pd 4.75978669 1.22592512 2.78504734 37.83590915 28.93822296 31.06658095 Pd 4.68365717 0.40358926 4.58343331 6.31189870 -3.95515514 13.88000918 Pd 2.49928362 1.34894620 4.72094491 8.03446026 4.80602430 12.80507575 Pd 0.23171545 3.18190327 2.81977045 -24.20215680 -8.12656644 -4.05649737 Pd 1.71219253 4.42485375 3.12990665 -10.33623400 36.59684990 -13.26957577 Pd 1.28220450 3.28278197 4.56210000 12.57575213 -42.38925062 26.47678154 Pd 0.13362859 4.32702941 4.57034430 -39.74296970 33.92562610 12.66381079 Pd 3.04852473 3.05473499 2.91561068 -11.41594755 -15.10310769 17.28426164 Pd 4.63661615 4.40480033 3.15906743 17.37154731 25.44332434 -9.07483118 Pd 4.29869006 3.11041876 4.26735611 23.22792384 -20.88755791 28.09783118 Pd 2.83533445 4.24148635 4.58611608 12.83588679 24.74423528 29.06732308