16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-29.891161194567562 stress="-0.012288644070253586 -0.0009252983267944984 0.0004064472763969496 -0.0009252983267944984 -0.012042142796347213 -0.006426207064744772 0.0004064472763969496 -0.006426207064744772 -0.010135320443718747" pbc="F F F" Hs 21.19883391 21.39984160 20.78169805 -45.02130248 -25.00410279 -46.15768420 Hs 22.70893381 22.23877089 22.29795969 -50.92996840 118.36234844 150.49479201 Hs 24.01071484 21.06150928 20.97196180 81.74034158 -84.23550980 -97.05924650 Hs 25.26121730 22.46330463 22.64367116 46.71681838 44.13519325 -22.98615492 Hs 21.40165343 24.09416137 21.14299952 -134.19428328 -181.53743845 -161.38699715 Hs 22.41156079 25.48877474 22.37302566 139.29307279 177.69254791 168.89317582 Hs 24.16565823 24.06254945 20.94865898 -29.99990418 -31.79590450 -30.82166109 Hs 25.26521406 25.49564951 22.45963824 23.92991781 33.17567443 26.95254489 Hs 20.90314731 21.28025313 24.35035323 7.58165542 -2.43122182 -4.71599248 Hs 22.65687010 23.00831688 25.46409952 -51.71901960 -95.34713861 102.40875637 Hs 24.09429422 20.95233181 23.96949546 -38.50069295 -44.68923724 31.40332644 Hs 25.40813876 22.11399328 25.76006514 0.22066811 12.87862625 2.45657959 Hs 20.96518149 23.84152857 24.02021575 -20.21370571 19.74736450 -34.28479575 Hs 22.78963645 25.54930887 25.06592197 -248.46733100 202.95589770 109.59357095 Hs 24.05083451 24.12839351 24.15960777 233.02141481 -178.29422014 -235.37595683 Hs 25.03365566 25.72587322 25.58658081 86.54231869 34.38712087 40.58574284