32
Lattice="12.031773400651215 0.0 0.0 0.0 12.031773400651215 0.0 0.0 0.0 12.031773400651215" Properties=species:S:1:pos:R:3:forces:R:3 energy=-24.659692261643848 stress="-0.0007674804133582064 4.256179038264507e-05 -1.6167635440199648e-05 4.256179038264507e-05 -0.0007702692113546849 -7.2426850464707295e-06 -1.6167635440199648e-05 -7.2426850464707295e-06 -0.0007673295179089458" free_energy=-24.659692261643848 pbc="F F F"
Ca       0.00083857       0.00713108       0.02697009      -0.05696688      -0.05213633      -0.06370756
Ca       2.99071080       2.94954034       0.01255992       0.16206478       0.20632691      -0.10307753
Ca       2.95136049       0.02156814       2.96683675       0.17352903      -0.11798074       0.19104227
Ca       0.01915397       2.96702686       2.96426215      -0.12299421       0.16419412       0.18064384
Ca       6.02174265       0.05472765       0.03536571      -0.11738330      -0.09765698      -0.07185221
Ca       9.01212675       2.95142818       0.04263012       0.05562098       0.14967528      -0.08719871
Ca       8.99726815       0.03375806       2.99735192       0.06569876      -0.08489172       0.14214694
Ca       5.97903009       2.99242870       3.04959058      -0.15783992       0.19281944       0.13858980
Ca       0.01047154       5.97478555       0.01907748      -0.04703917      -0.08323599      -0.06444233
Ca       3.00261699       9.00780472       0.05699441       0.08625781       0.05181297      -0.11057372
Ca       2.98095520       5.98875890       3.03113715       0.18941850      -0.15571420       0.14329378
Ca       0.02359654       9.04045342       2.94783083      -0.06458060       0.03798521       0.15335115
Ca       6.02112653       6.04517247       0.05155030      -0.15322745      -0.20611864      -0.10981101
Ca       9.04597558       8.98420296       0.06589091       0.02562770       0.04338832      -0.02605977
Ca       8.99981014       5.96824383       2.96532517       0.07257674      -0.12099590       0.19335472
Ca       5.95623784       8.98397822       2.98246695      -0.08456258       0.07470657       0.20950753
Ca       0.02783649       0.04815503       6.06729655      -0.07156686      -0.08013869      -0.12899268
Ca       2.95139119       3.02489241       6.01246475       0.22224064       0.11062980      -0.15084540
Ca       2.99140416       0.01110442       9.05835866       0.12573217      -0.05854097       0.04639758
Ca       0.02604950       2.97926444       9.06238322      -0.07793957       0.13235793       0.06508826
Ca       5.97817906       0.00748191       6.00816147      -0.15509307      -0.07925668      -0.13492655
Ca       9.00156008       2.98281706       6.03660847       0.09368289       0.13852628      -0.16854215
Ca       8.95783382       0.05182463       8.97750092       0.04584158      -0.06213111       0.05223278
Ca       5.99680244       2.98593281       9.00205734      -0.13232962       0.12727963       0.09245148
Ca       0.03856400       6.01325662       6.02209401      -0.13797100      -0.13203251      -0.13242186
Ca       2.97489996       8.96553334       6.07267454       0.18513332       0.08572721      -0.17791093
Ca       3.01797756       5.95634546       9.01391672       0.11975556      -0.08180513       0.10623766
Ca       0.04941342       9.01626479       9.02447238      -0.03575758       0.00896661       0.04436178
Ca       6.04930839       5.97105734       6.07085101      -0.21783263      -0.12044444      -0.25396578
Ca       8.98511086       8.98192566       5.97713845       0.06065822       0.05741941      -0.11978052
Ca       9.02830719       5.99894907       8.99090039       0.07876363      -0.10869338       0.08214501
Ca       6.05709000       8.98189378       9.01830393      -0.12951791       0.05995773       0.06326412