16 Lattice="21.0 0.0 0.0 0.0 21.0 0.0 0.0 0.0 21.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=185.4963991214793 stress="-0.047731064469332986 0.0017079453775228725 -0.005360827909306983 0.0017079453775228725 -0.05860336370236456 0.00215748166296204 -0.005360827909306983 0.00215748166296204 -0.04201062936382161" pbc="F F F" N 10.55134784 10.96048872 10.22592512 -27.03136267 -29.43338865 -31.95588029 N 11.03504734 11.43365717 11.45288723 -39.91170477 -65.43849683 -80.69726236 N 11.78686289 10.57772642 10.44809454 25.10106205 -22.48331826 -44.23524038 N 12.97094491 11.48171545 11.43190327 37.91503652 -19.70738474 -15.41001222 N 10.33184690 12.19672592 10.42485375 -20.91514280 36.24704218 -22.85632878 N 11.37990665 12.53220450 11.53278197 -53.20452264 203.97095020 -59.86076897 N 12.16380121 12.01156224 10.32702941 -6.10915147 -0.66130839 -42.21331618 N 12.82034430 12.79852473 11.02377885 26.38136910 39.85690047 0.92112305 N 10.41561068 10.63661615 11.90562635 -52.18040847 -71.74997487 21.53521186 N 11.37343602 11.19171408 12.86041876 -8.41320203 -35.59617529 47.24502787 N 11.76735611 10.33533445 11.59647529 26.08115394 -54.89952038 32.46831737 N 12.83611608 11.28369179 12.77598936 31.00493088 -39.49448665 30.26265312 N 10.22329650 11.96375436 11.90583543 -83.12519987 43.73912744 32.00031643 N 11.11602575 12.45178472 13.04874826 -12.53963702 32.99486721 29.33843961 N 11.77290972 11.88090187 11.86136659 141.84933477 -55.86634275 87.52758100 N 12.66348385 12.49645637 12.78474145 15.09744450 38.52150931 15.93013888