32 Lattice="6.871814681202363 0.0 0.0 0.0 6.871814681202363 0.0 0.0 0.0 6.871814681202363" Properties=species:S:1:pos:R:3:forces:R:3 energy=-113.8686611865831 stress="-0.019482313494952185 -0.00031489851122358336 0.000236015829654966 -0.00031489851122358336 -0.021059782229342534 0.0021247361660182472 0.000236015829654966 0.0021247361660182472 -0.019520005744973777" free_energy=-113.8686611865831 pbc="F F F" Ni 0.00864104 0.00621936 0.02186083 0.40181148 0.32354444 0.22096914 Ni 1.74031253 1.74260820 0.01808352 -0.24944671 -0.28539293 -0.76023277 Ni 1.69845235 0.00859672 1.72517816 0.25053657 -0.58799303 0.00039614 Ni 0.00419825 1.70168044 1.68519107 -0.68347421 0.29741274 0.31855370 Ni 3.41668003 0.00939205 0.01455934 -0.09236122 -0.26929529 -0.15981405 Ni 5.12993619 1.68582127 0.03807565 0.22382796 0.31698883 -0.43700948 Ni 5.15051138 0.01125234 1.70126599 0.07273241 -0.24679104 0.35441976 Ni 3.44575617 1.69806775 1.70780678 -0.34628681 0.32131230 0.50903037 Ni 0.02448994 3.43511041 0.02149187 -0.17337238 0.01286237 -0.19145317 Ni 1.71340010 5.15246922 0.06183837 0.05430530 0.18675510 -0.29548207 Ni 1.70386826 3.43689405 1.74408265 0.34106357 -0.31844797 0.02155433 Ni 0.02025184 5.13103256 1.74418781 -0.38007001 0.28719844 -0.04280226 Ni 3.42573787 3.44992292 0.02926597 0.29828684 0.08886616 -0.74417712 Ni 5.17538559 5.15972712 0.02054747 -0.48687888 -0.45006561 0.42776985 Ni 5.15888820 3.43301321 1.70535249 0.55396484 0.11849448 0.18841785 Ni 3.44343848 5.14514600 1.71837379 0.27415127 0.58325429 0.24914792 Ni 0.01490376 0.03293773 3.41256397 -0.11328973 -0.11134971 0.30008081 Ni 1.69344255 1.74478963 3.46913254 0.41245756 -0.27135081 -0.27811382 Ni 1.71935459 0.01319491 5.18071372 0.08984137 0.14992759 -0.20372306 Ni 0.02999962 1.74151785 5.16031229 -0.16241838 -0.03637324 0.15972734 Ni 3.44699768 0.02496926 3.45978303 -0.44799838 -0.65954188 -0.16671981 Ni 5.12405470 1.71453983 3.46125523 1.02795708 -0.05683632 -0.41037600 Ni 5.12064983 0.00638978 5.11581164 -0.10391330 0.16927089 -0.01195773 Ni 3.46030225 1.74654197 5.17851195 -0.43560212 -0.42102244 0.79987538 Ni 0.00655088 3.47463529 3.47119997 -0.85943322 -0.48478394 -0.14267567 Ni 1.71609112 5.12296774 3.43387515 0.29316852 0.94190049 0.29292708 Ni 1.73827189 3.46410962 5.17128618 -0.20569340 -0.17134931 0.76478972 Ni 0.00676488 5.12347505 5.16240537 0.32163427 -0.15185465 -0.21087279 Ni 3.45023232 3.40907939 3.46740941 -0.15255556 0.42819718 -0.59429228 Ni 5.16507942 5.14002945 3.45831017 -0.20266862 -0.09415171 -0.14082963 Ni 5.14951974 3.41699672 5.13863530 0.35175643 0.22469223 0.31162010 Ni 3.43400472 5.12035050 5.18112330 0.12796746 0.16592233 -0.12874776