32
Lattice="12.051293173752594 0.0 0.0 0.0 12.051293173752594 0.0 0.0 0.0 12.051293173752594" Properties=species:S:1:pos:R:3:forces:R:3 energy=-24.06278381957524 stress="-0.0005418822350936709 7.535324172124675e-05 0.00011216887435774093 7.535324172124675e-05 -0.0006240175601597078 2.323645054419313e-05 0.00011216887435774093 2.323645054419313e-05 -0.0005274107894832405" free_energy=-24.06278381957524 pbc="F F F"
Ca       0.01448344       0.05188584       0.02164747      -0.02776816      -0.04983392      -0.04379359
Ca       2.97770538       3.03230781       0.00319340       0.13021738       0.06960979      -0.07787498
Ca       2.95962113       0.01203296       3.07207808       0.19762605      -0.10153656       0.05512171
Ca       0.02138874       2.95856126       3.01866184      -0.08710628       0.22277976       0.12121930
Ca       5.98072799       0.01220394       0.00973548      -0.09915697      -0.05082939      -0.04924636
Ca       8.99483135       3.06886346       0.00336153       0.07410481       0.05412722      -0.05992854
Ca       8.97888619       0.03163780       3.03136068       0.09514304      -0.05805515       0.04798460
Ca       6.01735763       2.99486774       2.96538077      -0.13611247       0.17363329       0.22377730
Ca       0.01029250       6.01259974       0.01789967      -0.05754572      -0.06583210      -0.01117545
Ca       3.05288734       8.99092380       0.03279910       0.05631172       0.07939150      -0.06021037
Ca       3.08885481       6.00871260       2.97529680      -0.00630942      -0.14391180       0.22924667
Ca       0.00419848       9.08010163       3.06322514      -0.02564361       0.02043991       0.03199157
Ca       5.97769269       5.97239202       0.05520056      -0.02627218      -0.04169373      -0.11509517
Ca       9.08909949       8.98086847       0.05332840      -0.02767069       0.00597470      -0.01098150
Ca       9.07061668       6.03002937       3.03758361       0.02554659      -0.14781839       0.13769129
Ca       5.99594135       9.00255673       3.07102157      -0.04702182       0.10909591       0.06012659
Ca       0.01589223       0.05716935       6.02775809      -0.08005074      -0.07061574      -0.04708778
Ca       3.06343645       3.01937776       5.96796203       0.13907952       0.17151759      -0.07228331
Ca       2.97562658       0.01952754       9.06654267       0.12027652      -0.04580382       0.01096694
Ca       0.04781663       3.07037206       9.01439356      -0.06141410       0.08568684       0.04060563
Ca       6.08021695       0.05050617       6.01572436      -0.20680682      -0.11647396      -0.08124806
Ca       8.99346297       3.00119632       6.06228024       0.07747258       0.16299448      -0.16884101
Ca       9.02766855       0.01900294       9.06388137       0.03817802      -0.03873602       0.02686065
Ca       6.03502163       2.95849186       9.06141415      -0.18049711       0.18128214       0.05855895
Ca       0.03314191       6.05194681       5.98723183      -0.06775958      -0.16391115      -0.14647009
Ca       2.97962891       9.05025821       6.02721625       0.14127426       0.08982198      -0.11582492
Ca       2.99764904       6.04269891       8.98558343       0.20067542      -0.15638513       0.08638526
Ca       0.06403108       8.97228999       9.06350316      -0.05886846       0.04729342       0.03413610
Ca       5.98447598       6.08397630       6.01460000      -0.08777962      -0.25391538      -0.12160668
Ca       9.06500424       9.02899498       6.03134427       0.05238766       0.04529973      -0.08786486
Ca       9.00899734       5.96611358       9.01605291       0.04273414      -0.05553777       0.05522018
Ca       6.05308811       9.05581960       9.01968571      -0.10724396       0.04194175       0.04963994