32
Lattice="88.83128547668457 0.0 0.0 0.0 88.83128547668457 0.0 0.0 0.0 88.83128547668457" Properties=species:S:1:pos:R:3:forces:R:3 energy=-17.52420752438589 stress="-3.812917872607627e-05 4.989885921701748e-07 -1.3117197973921638e-06 4.989885921701748e-07 -3.758577801258845e-05 -1.3971491469036301e-06 -1.3117197973921638e-06 -1.3971491469036301e-06 -3.923238405960544e-05" pbc="F F F"
Ba      44.29514698      44.50827173      44.50768370      -0.19633865      -0.27373594      -0.30693580 
Ba      47.79093322      47.43105074      44.28092204      -0.11452486       0.45934002      -0.30041691 
Ba      47.41176861      44.27822421      47.72685825       0.28666936      -0.34178280       0.16383785 
Ba      44.23074925      47.60384602      47.44514241      -0.35360161       0.17401083       0.20872636 
Ba      50.42747668      44.38143290      44.58447099       0.23600977      -0.53157483      -0.26657446 
Ba      53.98748154      47.34540484      44.30356117       0.23092352       0.18156703      -0.32751141 
Ba      53.75663563      44.60128510      47.74305845       0.35442408      -0.76077730      -0.26538069 
Ba      50.91375798      47.75137132      47.68035903      -0.63541140      -0.13407195       0.12395749 
Ba      44.64030445      50.90761983      44.29399673      -0.41971936      -0.35390392      -0.57325369 
Ba      47.68468768      53.92667321      44.54314466       0.03632741       0.54271711      -0.68141977 
Ba      47.41658891      50.72552338      47.52028996       0.42018822      -0.56918971       0.18029919 
Ba      44.38055387      53.84016115      47.39686867      -0.44790584       0.60212546       0.21644133 
Ba      50.92055638      50.90986388      44.65848333      -0.31573247      -0.42187801      -0.88179288 
Ba      54.02874179      53.96039365      44.53984848       0.21339467       0.34355237      -0.18708267 
Ba      53.75070735      50.84914534      47.55988863       0.86628744      -0.20388206       0.22522464 
Ba      50.35053870      53.78459378      47.59953530       0.35378626       0.79113705       0.36564186 
Ba      44.29229862      44.39537225      50.81348395      -0.51984079      -0.35161014      -0.22311820 
Ba      47.53606733      47.40357913      50.75616313       0.22965299       0.48159200      -0.26135180 
Ba      47.45591215      44.28348190      53.78051494       0.13386976      -0.53137466       0.44398989 
Ba      44.34886269      47.37482654      54.00889635      -0.29594825       0.39238755       0.28969636 
Ba      50.98756758      44.36048712      51.11913244      -0.38582925      -0.44292264      -0.35530510 
Ba      54.14976938      47.35979292      50.58160734       0.44932914       0.64540325       0.32048884 
Ba      54.08632811      44.58471543      54.00280823       0.27518539      -0.12156254       0.38002891 
Ba      50.40137101      47.54493410      54.11740123       0.13335902       0.31291014       0.35046025 
Ba      44.60873895      50.91232062      50.51301526      -0.66291187      -0.43416157       0.22952228 
Ba      47.64948792      53.87065859      50.86899010       0.02147214       0.70983221      -0.29645663 
Ba      47.40669240      50.99638620      53.98503047       0.23641130      -0.78715464       0.44798823 
Ba      44.52699990      53.78913831      53.99190072      -0.53918707       0.45330620       0.24849212 
Ba      50.80117183      50.80634705      50.69041013      -0.38005304      -0.47316965       0.03325923 
Ba      54.04712726      53.85394741      50.70702655       0.24923798       0.52692935      -0.16541291 
Ba      53.76552218      50.85275020      53.73941056       0.46059924      -0.44935382       0.44687486 
Ba      50.62351326      53.71785243      54.00504387       0.07987679       0.56529560       0.41708324