16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1.661974122633393 stress="-21.411362925934593 3.957990326087983 4.68247590042243 3.957990326087983 -21.58475982023841 -4.133997961787767 4.68247590042243 -4.133997961787767 -23.589684367257522" pbc="F F F" Cd 0.00779751 -0.20494074 0.18365717 -0.25448558 -0.22642552 -0.37400643 Cd 1.70288723 1.56796670 1.29585403 -3.24543445 0.27002438 1.44778302 Cd 2.94809454 0.22094491 0.23171545 1.69180918 -2.56599280 -2.26190246 Cd 4.68190327 1.32183498 1.81389373 1.16563950 0.32655762 -0.45337850 Cd -0.19721260 2.84895051 -0.21696948 -0.18058365 0.13408183 -0.14079552 Cd 1.78278197 4.56210000 1.63362859 -2.26779265 3.01393735 -1.07660678 Cd 2.82702941 3.07034430 0.04852473 1.53032331 0.77019119 -2.51792862 Cd 4.55473499 4.41561068 1.88285712 1.50720325 0.98379401 -0.76647566 Cd -0.09519967 -0.12280496 2.94171408 -0.57253607 -0.64154979 -0.01690957 Cd 1.61041876 1.26735611 4.33533445 -1.65006789 2.02478299 3.20769582 Cd 2.74148635 0.08611608 3.03369179 1.62098617 -3.31307382 -1.77920023 Cd 4.52598936 1.22329650 4.46375436 0.56358860 0.31057824 0.84852677 Cd -0.09416457 2.61058609 2.81221332 -0.87543564 0.67023889 0.07580804 Cd 1.79874826 4.27290972 4.38090187 -1.17447476 0.99350471 1.57696013 Cd 2.86136659 3.05835534 2.74645637 1.63377020 -2.82267374 1.73348128 Cd 4.48193431 4.27514716 4.61404086 0.50749048 0.07202445 0.49694871