256 Lattice="10.414555309942617 0.0 0.0 0.0 10.414555309942617 0.0 0.0 0.0 10.414555309942617" Properties=species:S:1:pos:R:3:forces:R:3 energy=-489.0136902343918 stress="-3.849312635654522 -0.00716779678318825 0.013882796687690286 -0.00716779678318825 -3.8459212207801823 -0.002222675879378082 0.013882796687690286 -0.002222675879378082 -3.8610408838384447" free_energy=-489.0136902343918 pbc="F F F" C 0.00523236 0.01586128 0.01445526 6.72112443 8.59361690 8.31022990 C 1.28196150 1.32508569 0.00607233 -11.20703855 -8.84497313 -16.57300347 C 1.32746985 0.02420835 1.31204661 -7.17706610 -13.81035061 -8.08556415 C 0.00178961 1.28845050 1.27713879 -14.50254592 -11.28952304 -10.03525928 C 2.60716066 0.03428304 0.00891671 -0.13392336 -0.87629223 -1.05406453 C 3.90526269 1.30402169 0.02131648 1.98916040 -10.78795876 -18.54059047 C 3.90328063 0.02385529 1.32584683 0.79293759 -18.27942289 -10.16338214 C 2.60626251 1.31425241 1.28509084 -2.06541533 -11.67360709 -8.19204018 C 5.20689437 0.00853184 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