32
Lattice="16.089243617857214 0.0 0.0 0.0 16.089243617857214 0.0 0.0 0.0 16.089243617857214" Properties=species:S:1:pos:R:3:forces:R:3 energy=-9.18704682698628 stress="-4.0685311075983977e-05 5.567670733381693e-06 2.2720246338171073e-05 5.567670733381693e-06 -5.713477109461544e-05 -1.0614684871091686e-05 2.2720246338171073e-05 -1.0614684871091686e-05 -4.908733442430139e-05" free_energy=-9.18704682698628 pbc="F F F"
K        0.05785103       0.00091928       0.00633731      -0.00720176      -0.00963742      -0.00849613
K        3.94325975       4.07326780       0.05696554       0.04658581       0.02716454      -0.02973611
K        4.07156185       0.06660869       3.96139506       0.03057822      -0.02491382       0.04988774
K        0.01089087       3.97147455       3.97073765      -0.02331676       0.04246953       0.04432017
K        8.00911693       0.07287722       0.02014890      -0.01734829      -0.00615588      -0.01355202
K       12.11322512       4.08293348       0.06025906       0.00578436       0.02433541      -0.00931352
K       12.11849177       0.03507942       4.03984692       0.00051257      -0.01186335       0.02665694
K        7.96506101       4.09436798       4.10237848      -0.02440736       0.02671638       0.03158080
K        0.08011045       8.02532441       0.02351401      -0.02085458      -0.02099598      -0.01306203
K        3.96598418      12.10971555       0.02992888       0.03556468       0.01196722      -0.01677448
K        4.09723773       8.02757707       4.05873011       0.01890862      -0.03603823       0.04627697
K        0.03597992      12.07447153       3.99716661      -0.01558846       0.00949679       0.03322562
K        7.97006423       7.98603412       0.07059518      -0.01907151      -0.02279584      -0.02594875
K       12.08212051      12.10490942       0.02876980      -0.00520945      -0.00224077      -0.00087816
K       12.12272104       8.09319881       4.04357884       0.01554582      -0.03294457       0.02651678
K        7.98455838      12.00692240       4.03516287      -0.02597770       0.02770025       0.03273021
K        0.03870856       0.06041290       8.02917292      -0.00907541      -0.02039301      -0.02821790
K        4.01132644       4.05923687       8.07601081       0.04916894       0.03482588      -0.05495357
K        4.06757402       0.05503800      12.12398048       0.01877664      -0.01826478       0.01532228
K        0.04121771       4.01134423      12.00586456      -0.02214051       0.02842678       0.02236766
K        7.98475774       0.04881312       8.11863174      -0.02773033      -0.02137312      -0.04969311
K       12.01111081       4.06251583       7.96428652       0.01928982       0.02594020      -0.02285741
K       12.00739570       0.01909410      12.05946296       0.00664701      -0.00031496       0.00165119
K        8.02024730       4.03303982      12.08108293      -0.02463079       0.04413596       0.01722641
K        0.06274285       7.99305479       7.99300015      -0.02813038      -0.02861277      -0.03917971
K        3.95427380      12.07121404       8.11311722       0.04869790       0.02032795      -0.04191706
K        4.02008655       7.99638434      11.99740719       0.03878208      -0.02313519       0.02643408
K        0.00655556      12.04772767      11.99865085      -0.00928443       0.00049752       0.00891531
K        8.06198927       8.07533175       7.98663910      -0.04362344      -0.04031815      -0.02143427
K       12.09794580      12.08541295       8.04500692       0.00861187       0.01340016      -0.02445056
K       12.14072367       7.97103152      12.03231865       0.00820798      -0.02308509       0.00973399
K        8.08904744      12.03292157      12.11869201      -0.02807119       0.00567835       0.00761866