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=109.46237982582923 stress="-7.0162031492230374 -0.3473465559861983 -0.07572359811675373 -0.3473465559861983 -6.7236924724392155 0.5183296573363173 -0.07572359811675373 0.5183296573363173 -4.157800548571667" pbc="T T F" Ca 0.06504129 -0.29134056 0.22277084 9.55323284 19.85454713 -40.19389132 Ca 1.68584377 1.68362810 0.19581920 -12.39851453 -9.64261795 -41.86857435 Ca 1.64685009 0.42259636 1.67626233 -10.32156875 -7.01868396 37.84257506 Ca -0.14597521 1.70996341 1.49207130 13.16685044 -3.19324522 44.21989062