32 Lattice="7.50983487820871 0.0 0.0 0.0 7.50983487820871 0.0 0.0 0.0 7.50983487820871" Properties=species:S:1:pos:R:3:forces:R:3 energy=-107.74866245827224 stress="-2.837230464212151 0.24958506108429535 -0.5588519848609872 0.24958506108429535 -3.5302161215089276 0.6844134854527137 -0.5588519848609872 0.6844134854527137 -3.5051132258881013" pbc="F F F" Pd -0.03380079 -0.00287984 -0.02120547 0.82630476 0.81593579 0.83138139 Pd 1.88233583 1.84208318 -0.00264581 -0.64413181 -0.28092559 -0.54192017 Pd 1.89259247 0.01855919 1.89028883 -0.59116400 -0.79929540 -0.55353298 Pd -0.02685106 1.86878100 1.90760270 -0.48412071 -0.38315074 -0.78782598 Pd 3.75351599 -0.00709823 -0.02104656 0.23490482 0.21589562 0.33370442 Pd 5.63005226 1.84185811 0.03699029 -0.14343076 -0.13276397 0.11679992 Pd 5.64704088 -0.00573276 1.88540715 -0.34194056 0.14400315 -0.24044128 Pd 3.73445797 1.89353608 1.87645946 0.62230161 -0.42923660 -0.27567384 Pd -0.01053578 3.74242676 0.00978283 0.16454992 0.04281366 0.06178638 Pd 1.88781557 5.62667552 0.04340070 -0.23549423 0.02464418 -0.23244479 Pd 1.84913187 3.77580711 1.85815624 -0.09393001 -0.33673064 -0.14255513 Pd 0.01382468 5.58355854 1.88025641 -0.34481743 0.21138894 -0.23525336 Pd 3.76506450 3.74492725 0.01545216 0.48973863 0.39128085 -0.72550405 Pd 5.63262032 5.66890046 0.00526136 -0.74030076 -0.78603354 0.75414873 Pd 5.65883336 3.75715046 1.89254915 0.53406986 0.23871295 -0.55636031 Pd 3.74507840 5.59537558 1.87645377 0.69886134 0.92314027 -0.42444205 Pd -0.03246453 0.03704274 3.75153652 0.16165457 0.09105297 0.30043315 Pd 1.87670697 1.86863142 3.74179429 -0.36810343 -0.08218603 0.51717031 Pd 1.86236426 0.00616914 5.59671352 -0.31865139 0.13957907 -0.01285907 Pd -0.01803538 1.90811510 5.65848465 0.32680887 -0.29239748 -0.26486231 Pd 3.75647105 0.01834392 3.78536833 0.34781712 -0.84227407 0.09077594 Pd 5.63325083 1.82413063 3.75295968 0.55982064 0.07895245 0.34724093 Pd 5.60320512 0.00583313 5.63306344 -0.44869409 0.46940108 -0.42617133 Pd 3.73876207 1.87990430 5.63706396 0.33915549 -0.20627616 0.59900589 Pd 0.02210552 3.73546386 3.77753932 -0.89392496 0.42974992 0.32195116 Pd 1.84964741 5.65597994 3.72336070 -0.12678983 0.66579276 0.60813109 Pd 1.87555483 3.78716424 5.59552576 -0.34226373 0.18432149 0.85105620 Pd 0.03307138 5.65472535 5.63194436 0.52937649 -0.56308318 -0.57816679 Pd 3.75744194 3.78168777 3.74786953 0.22172832 -0.13748175 0.29410510 Pd 5.65412053 5.58302680 3.75180220 -0.06386047 0.10447897 0.22131771 Pd 5.60412589 3.75726441 5.63172848 0.02498557 -0.00751732 -0.09309812 Pd 3.77152369 5.58953820 5.64827846 0.09954016 0.10820836 -0.15789675