32
Lattice="12.051293568153117 0.0 0.0 0.0 12.051293568153117 0.0 0.0 0.0 12.051293568153117" Properties=species:S:1:pos:R:3:forces:R:3 energy=-24.092879433644953 stress="-0.00025193744491996403 -0.00011862451509430129 7.932590124369018e-05 -0.00011862451509430129 -0.0002918805957973469 -3.698226001768997e-06 7.932590124369018e-05 -3.698226001768997e-06 -0.0003571320109040219" free_energy=-24.092879433644953 pbc="F F F"
Ca       0.05489665       0.00349729       0.05706738      -0.01051316      -0.01475270      -0.01482679
Ca       3.07104467       3.00950648       0.02723196       0.07110034       0.14930095      -0.04775226
Ca       3.05482276       0.04569012       3.05618914       0.08325283      -0.10974322       0.07017352
Ca       0.00237464       3.03391833       3.03078115      -0.06517639       0.09611201       0.07782543
Ca       5.99789655       0.00062170       0.01225111      -0.09609968      -0.07462050      -0.07633639
Ca       9.03552517       2.96768214       0.04191078       0.03855916       0.14256434      -0.10026067
Ca       8.98819790       0.01773647       2.95599592       0.09496048      -0.10574513       0.14801868
Ca       6.06883732       2.97634137       3.03871244      -0.19397275       0.25274745       0.12802744
Ca       0.03383933       6.05917016       0.00331968      -0.03539122      -0.13401564      -0.06092049
Ca       3.00459212       9.08617529       0.03907710       0.11268165       0.04944060      -0.06353725
Ca       2.98824262       6.02959445       3.05525684       0.19589753      -0.18971992       0.08717063
Ca       0.01188958       9.04492959       2.95774814      -0.08063356       0.05583155       0.14184529
Ca       6.00280258       6.07646232       0.03006785      -0.09889403      -0.16123714      -0.06493019
Ca       9.04774849       9.06731700       0.00723992       0.00362806       0.00986278      -0.00171069
Ca       9.02894165       6.00757896       2.98092831       0.06540605      -0.07189463       0.14780326
Ca       6.00838372       9.01489195       3.02534731      -0.05352907       0.08871650       0.12369227
Ca       0.04846387       0.01243033       6.03389055      -0.06955222      -0.07730978      -0.10673057
Ca       3.04710776       2.96947227       5.98274841       0.14226887       0.25538151      -0.07304296
Ca       3.07288330       0.01742340       9.01807044       0.08530277      -0.06700841       0.06206669
Ca       0.03967709       2.98083062       9.00745193      -0.01831614       0.13915916       0.05874795
Ca       6.04472175       0.00647267       6.01079247      -0.07814140      -0.07514043      -0.07575370
Ca       9.07965565       3.02327790       6.00957871       0.03639264       0.12268305      -0.12889134
Ca       9.06267049       0.08217354       8.97912282       0.01123427      -0.02578749       0.03939012
Ca       6.00337158       3.05811920       9.04405188      -0.06845132       0.08065653       0.03080867
Ca       0.01809551       6.00463646       6.01759666      -0.04044551      -0.06985134      -0.04628129
Ca       3.01126308       9.04089637       5.96647755       0.07479366       0.07290214      -0.06271227
Ca       3.11172710       6.07673135       9.08128518      -0.01402627      -0.15018620       0.00900144
Ca       0.04171129       9.09454762       9.05080372       0.01053110      -0.01861086      -0.01474405
Ca       6.01319937       6.04041959       6.01243023      -0.09193239      -0.18089448      -0.14551221
Ca       9.08907728       9.04776248       6.07667529       0.02404976       0.01231142      -0.13472985
Ca       9.09492881       5.97619458       9.02914039       0.00428519      -0.05620494       0.04095355
Ca       6.00404131       9.06790825       8.98077520      -0.03926925       0.05505278       0.05314801