32 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=432.97279066690385 stress="-971.5558339363736 17.577284598722372 -58.180930382548894 17.577284598722372 -962.3528724978228 -89.81057311569248 -58.180930382548894 -89.81057311569248 -953.3504658553583" pbc="F F F" Rb -0.14459490 0.11115480 0.11044915 -9.11043361 -38.86449354 -29.56275319 Rb 1.70960170 1.31143450 -0.16166483 -10.06635945 12.63950183 -20.04963934 Rb 1.32198775 -0.16490224 1.66640352 1.27230983 -24.82166167 -6.31797612 Rb -0.22187219 1.51878885 1.05164101 -18.28538268 26.54171312 23.15596462 Rb 2.87679405 -0.04105180 0.20259391 8.33628205 -30.51359956 -11.05337008 Rb 4.56504129 1.17241380 -0.13449789 14.26982868 2.73541086 -18.28069950 Rb 4.28802619 0.22277084 1.68584377 16.43219915 -68.05769871 -59.77486425 Rb 3.18362810 1.69581920 1.64685009 -59.13913673 -50.96978749 -2.30668581 Rb 0.26959405 3.17626233 -0.14597521 -15.22330548 -25.02324251 -47.75326421 Rb 1.70996341 4.49207130 0.15300231 -6.95134810 37.66821625 -43.49209335 Rb 1.53848316 2.95774659 1.32435701 -14.26169367 -23.85223688 9.11347595 Rb -0.04210664 4.38825682 1.02601319 -29.39326009 37.61382886 25.19528321 Rb 3.19178619 3.17895518 0.29140871 -11.78885867 -17.07102520 -81.99883719 Rb 4.61455359 4.53253581 0.14904689 16.80394522 16.81993638 -9.86394178 Rb 4.28091226 2.80787766 1.46603997 99.27861434 29.42545012 10.28278981 Rb 2.80598025 4.32157598 1.51361598 20.11888648 58.45941254 28.08360139 Rb -0.14801295 -0.02432459 3.36204753 -43.30214019 -32.84790395 -29.43917079 Rb 1.21036414 1.27846858 2.87541615 9.51030370 20.56369494 1.73198359 Rb 1.34126820 -0.15859300 4.31668137 23.07803268 -26.93801045 25.91603985 Rb -0.08013605 1.24396547 4.59073906 -15.08747063 27.39169208 32.01825656 Rb 3.27219963 -0.06618674 3.13132919 -22.91372419 -26.26685525 13.20988788 Rb 4.75978669 1.22592512 2.78504734 48.83012969 45.67414663 54.62857616 Rb 4.68365717 0.06425382 4.58343331 15.15687045 -8.40563702 15.65352902 Rb 2.85420938 1.19455091 4.72094491 0.29212091 10.74389121 16.45478870 Rb 0.23171545 3.18190327 2.80376929 -30.61193851 -6.58745716 -1.05062701 Rb 1.71219253 4.42485375 3.12990665 -13.53103382 42.39543929 -16.48653956 Rb 1.28220450 3.28278197 4.56210000 32.97650356 -70.83827773 28.66987973 Rb 0.13362859 4.32702941 4.57034430 -64.38223966 56.98927825 14.04739494 Rb 3.04852473 3.05473499 2.91561068 -12.81961598 -13.72921357 19.08734711 Rb 4.63661615 4.40480033 2.79721369 18.56724799 23.41121889 -1.32529725 Rb 4.29869006 3.11041876 4.26735611 33.25702885 -15.37167651 27.68183452 Rb 2.83533445 4.24148635 4.58611608 18.68763787 31.08594597 33.82512641