32
Lattice="12.031382298587328 0.0 0.0 0.0 12.031382298587328 0.0 0.0 0.0 12.031382298587328" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-24.772731886116663 pbc="F F F"
Ca       0.04661226       0.00852976       0.02672020       20      -0.04924724      -0.04154308      -0.03960059 
Ca       2.95286755       3.01517591       0.04418189       20       0.16567288       0.14979349      -0.12620554 
Ca       2.99298197       0.04622088       2.99476231       20       0.13480621      -0.11087512       0.14582661 
Ca       0.02092037       2.99912108       3.01387664       20      -0.10332429       0.15949572       0.15438362 
Ca       5.97068083      -0.04708808      -0.02560291       20      -0.07563598      -0.00303577      -0.03373750 
Ca       9.06692527       2.99662184      -0.00972162       20       0.01360664       0.08086813      -0.02807606 
Ca       8.98319234      -0.00487969       3.00399878       20       0.03431647      -0.04664270       0.06687671 
Ca       5.97333571       3.04461881       2.95012431       20      -0.10472871       0.12944551       0.20516635 
Ca      -0.04782618       6.01314768      -0.00746600       20      -0.02795011      -0.06927197      -0.03406660 
Ca       3.03055199       9.05688746      -0.03580732       20       0.07596854       0.01821783      -0.02658350 
Ca       2.98847553       6.05824786       2.98772295       20       0.16200048      -0.19554741       0.14857514 
Ca       0.03360960       9.01220932       3.02960270       20      -0.08369844       0.06758098       0.04427745 
Ca       6.03385319       6.00847101      -0.02696058       20      -0.12117959      -0.11080770      -0.07685878 
Ca       9.06529406       9.03031638       0.03118492       20       0.01881917       0.00815125      -0.02974378 
Ca       9.03329999       6.02206070       3.01629835       20       0.07219428      -0.15647213       0.11758701 
Ca       6.06809027       8.98005046       2.97315285       20      -0.15518761       0.10477721       0.11758264 
Ca       0.01318106       0.01318644       6.04052762       20      -0.07010845      -0.07061736      -0.12106436 
Ca       2.99218916       2.98196381       6.04145509       20       0.21211919       0.22009886      -0.19694267 
Ca       2.95116886       0.01852780       9.04690972       20       0.14003701      -0.06823906       0.06008381 
Ca       0.02813742       3.03448906       8.99238605       20      -0.09564313       0.09795613       0.07857114 
Ca       5.97524051      -0.01691572       5.97659939       20      -0.10868180      -0.06001197      -0.07589491 
Ca       8.99568748       2.95577070       5.99679166       20       0.03843834       0.16849117      -0.10941722 
Ca       9.00708378      -0.00367351       9.06343868       20       0.01081984      -0.02754749      -0.00847863 
Ca       6.04246993       2.95822548       9.02531410       20      -0.17808766       0.17536933       0.03866650 
Ca       0.02541232       6.05060921       6.03226335       20      -0.09075191      -0.15770472      -0.17048456 
Ca       2.99996811       9.06571433       5.95615627       20       0.16073535       0.08758698      -0.05176914 
Ca       2.95415330       6.05246731       8.98570805       20       0.21550908      -0.14425346       0.08000900 
Ca      -0.00287158       8.99845816       9.00858634       20      -0.02568585       0.05160972       0.02119916 
Ca       5.97790123       6.07032600       5.98592921       20      -0.14847706      -0.25793543      -0.11384827 
Ca       9.00813675       8.99572113       6.05689716       20       0.06300826       0.07556992      -0.11864183 
Ca       8.97113141       6.01994715       9.01859597       20       0.06624042      -0.14220595       0.04243879 
Ca       6.02999648       8.99455834       9.05716052       20      -0.14590436       0.06769911       0.04017001