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=19873.77440804718 stress="-3297.899479410192 -153.90804473278334 65.98667272385845 -153.90804473278334 -2725.9699148154846 -644.190368583088 65.98667272385845 -644.190368583088 -2982.393664482513" pbc="T F F" Er -0.09286756 0.25753704 0.13074468 -12335.62237710 -35851.71659007 -41118.81373729 Er 1.28593400 1.64605607 0.04467137 13144.91778668 19294.70680954 -24270.76146539 Er 1.33912102 0.16789924 1.35099296 8978.19418189 -16803.12036099 26046.92510924 Er -0.12038456 1.61556308 1.31652776 -9787.48959147 33360.13014152 39342.65009343