32 Lattice="13.13496850720263 0.0 0.0 0.0 13.13496850720263 0.0 0.0 0.0 13.13496850720263" Properties=species:S:1:pos:R:3:forces:R:3 energy=-23.024160396808984 stress="-0.00041069506622759083 1.8209184795462594e-05 6.433950303561972e-05 1.8209184795462594e-05 -0.00040233813100808196 4.744198874915886e-05 6.433950303561972e-05 4.744198874915886e-05 -0.0004299811109762926" free_energy=-23.024160396808984 pbc="F F F" Sr 0.01870993 0.04687385 0.01516998 -0.02307025 -0.03341693 -0.03465856 Sr 3.29592972 3.27946349 0.01483178 0.08752355 0.13246556 -0.05072964 Sr 3.21809802 0.01589657 3.32957916 0.18627578 -0.06479461 0.06113197 Sr 0.00717745 3.24535697 3.28209317 -0.06455508 0.18796539 0.09891301 Sr 6.54362377 0.02451731 0.03678213 -0.10296590 -0.07219889 -0.05762053 Sr 9.86965206 3.22559284 0.02784072 0.06835866 0.12285452 -0.07821809 Sr 9.83005058 0.02840427 3.23856169 0.05576506 -0.06897529 0.14657549 Sr 6.61954173 3.29058606 3.22638585 -0.19146290 0.10883574 0.21218476 Sr 0.01130338 6.62330403 0.02435842 -0.03723239 -0.12038495 -0.02894819 Sr 3.25509295 9.87582901 0.01988563 0.12488315 0.03274504 -0.03287876 Sr 3.33248007 6.59143324 3.28863168 0.08359699 -0.15483808 0.09554169 Sr 0.00586839 9.85802500 3.30897241 -0.05216701 0.04422642 0.07996699 Sr 6.62326227 6.54858903 0.03404180 -0.14626176 -0.07880026 -0.08570326 Sr 9.82993541 9.81744026 0.06702947 0.04623865 0.03768654 -0.04805779 Sr 9.83786480 6.58091694 3.29879476 0.08993245 -0.12821891 0.11446845 Sr 6.62459705 9.87952269 3.28345781 -0.16467600 0.06398224 0.11412899 Sr 0.05027246 0.02778218 6.54522008 -0.08325459 -0.06058015 -0.04138368 Sr 3.28972402 3.31223427 6.54992132 0.16218306 0.14146073 -0.11678384 Sr 3.27565719 0.03592962 9.83986579 0.10373070 -0.04524863 0.05106034 Sr 0.06017064 3.29261712 9.83420674 -0.05825205 0.09519177 0.04922734 Sr 6.54496855 0.02487355 6.58478710 -0.10315388 -0.04242089 -0.15075397 Sr 9.84062582 3.31077535 6.59981330 0.06141093 0.08848444 -0.16866848 Sr 9.81337622 0.02894727 9.75965500 0.04732453 -0.04913415 0.04430428 Sr 6.63119641 3.29581327 9.87004826 -0.18430696 0.11670729 0.05569781 Sr 0.01226970 6.58401683 6.58369639 -0.06974683 -0.15355309 -0.14702948 Sr 3.24524940 9.80990209 6.56058915 0.17348856 0.09592076 -0.10669173 Sr 3.29294964 6.62643528 9.86054768 0.13742115 -0.15876004 0.06227015 Sr 0.02443263 9.79258265 9.79182860 -0.05082514 0.05430693 0.05074673 Sr 6.53026372 6.54531710 6.52006731 -0.09673120 -0.11764768 -0.07976911 Sr 9.81653394 9.82648507 6.59471881 0.06743151 0.04107028 -0.09269912 Sr 9.86060018 6.53076628 9.83994274 0.04979029 -0.05620932 0.04525832 Sr 6.63042784 9.82460143 9.84073527 -0.11669308 0.04127824 0.03911790