4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=119.21916061178194 stress="-7.382743753964363 0.08402869959191889 -0.19286166269696564 0.08402869959191889 -7.679445293783215 -0.1153081894315554 -0.19286166269696564 -0.1153081894315554 -7.801440566146659" pbc="T T T"
Ca      -0.14459490       0.11115480       0.11044915      10.79890015     -12.68421261      -2.26438608 
Ca       1.70960170       1.31143450      -0.16166483     -16.42164434      13.85115904       3.04491805 
Ca       1.28829595       0.03769167       1.64041416      -4.93748348      -8.76966961      -5.15491394 
Ca      -0.22187219       1.51878885       1.32834452      10.56022766       7.60272319       4.37438197