32 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=800.8747904105569 stress="-0.02717422517327565 0.000912767202058956 -0.0026258351196842803 0.000912767202058956 -0.02784649759874869 0.0005091271679297119 -0.0026258351196842803 0.0005091271679297119 -0.02765948613138947" free_energy=800.8747904105569 pbc="F F F" Ar 20.85540510 21.11115480 21.11044915 -20.83641096 -44.38980329 -45.20158459 Ar 22.70960170 22.31143450 20.83833517 -57.10935007 79.00666912 -58.35706783 Ar 22.32198775 20.83509776 22.66640352 7.39446713 -57.91815950 -12.02695473 Ar 20.77812781 22.51878885 22.32834452 -35.16161926 30.05365428 19.10548132 Ar 23.60009055 20.95894820 21.16634827 69.19098694 -112.29750620 -14.99678656 Ar 25.56504129 22.11449487 20.86550211 25.89717980 3.29855764 -41.37145394 Ar 25.28802619 21.22277084 22.68584377 23.43035132 -151.81302683 -139.76833423 Ar 24.18362810 22.69581920 22.40244725 -110.34588615 -108.77393602 14.49124160 Ar 21.26959405 24.17626233 20.85402479 -70.88424950 -11.72261222 -73.76248464 Ar 22.70996341 25.49207130 21.15300231 -35.83699928 104.41849458 -99.38490285 Ar 22.53848316 23.95774659 22.12030630 -28.86647313 -73.23244180 69.25919983 Ar 20.95789336 25.38825682 22.56916429 -44.40883559 89.70863422 -47.46408995 Ar 24.19178619 24.17895518 21.29140871 -18.39795449 -25.45356551 -212.15328512 Ar 25.61455359 25.53253581 21.14904689 36.45928876 38.25099876 -20.00964428 Ar 25.28091226 23.87900266 22.46603997 218.93437854 53.90951257 62.28797784 Ar 23.80598025 25.32157598 22.51361598 45.14726133 131.35713020 76.81313295 Ar 20.85198705 20.97567541 24.06329927 -73.71647479 -44.28045599 -19.66521749 Ar 22.31835629 22.27846858 23.85588087 29.59278354 58.47207405 8.41399214 Ar 22.34126820 20.84140700 25.31668137 23.88530047 -61.42729279 39.99434363 Ar 20.91986395 22.24396547 25.59073906 -32.10044443 34.34394609 39.44049709 Ar 24.27219963 20.93381326 24.13132919 -57.71121401 -47.34157344 39.68074221 Ar 25.75978669 22.22592512 23.78504734 95.09662725 118.65435314 109.31700907 Ar 25.68365717 21.26124257 25.58343331 20.89277070 -11.40439272 40.73364785 Ar 23.54231040 22.43002885 25.72094491 19.05135338 13.91915027 27.38133718 Ar 21.23171545 24.18190327 23.74185363 -38.04824630 -75.19351007 52.17255127 Ar 22.71219253 25.42485375 24.12990665 -27.90915575 91.27899504 -42.18170579 Ar 22.28220450 24.28278197 25.56210000 69.67322981 -163.18270029 57.25923441 Ar 21.13362859 25.32702941 25.57034430 -145.84323415 126.74269910 26.82848520 Ar 24.04852473 24.05473499 23.91561068 -36.86803894 -57.50835015 19.26248006 Ar 25.63661615 25.40480033 24.07789707 41.91942560 72.73950047 -36.68290188 Ar 25.29869006 24.11041876 25.26735611 66.93385714 -70.72652464 83.14542944 Ar 23.83533445 25.24148635 25.58611608 40.54532510 70.51148191 77.43963080