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=240.93506172595653 stress="-0.015712444605164206 -0.00022939201060208554 -0.00046910632200043473 -0.00022939201060208554 -0.015085987972740435 -0.0013661530864305846 -0.00046910632200043473 -0.0013661530864305846 -0.015536954362895712" free_energy=240.93506172595653 pbc="F F F" Re 20.85540510 21.11115480 21.11044915 -11.96634257 -43.47752989 -34.85428117 Re 22.74329349 22.31143450 20.83833517 -15.06418018 23.30552937 -26.19674121 Re 22.28829595 20.83509776 22.66640352 12.45715419 -24.22768092 -4.41322409 Re 20.77812781 22.51878885 22.05164101 -20.51725654 33.74818442 31.86356166 Re 23.84054841 20.95894820 21.20259391 7.03471532 -45.11289906 -15.20193782 Re 25.56504129 22.11449487 20.86550211 22.46985254 8.51830616 -25.82667013 Re 25.28802619 21.22277084 22.68584377 12.85823763 -82.15049825 -66.27862470 Re 24.18362810 22.69581920 22.40244725 -29.80472717 -27.31360480 9.63990244 Re 21.26959405 24.17626233 20.85402479 -19.69337554 -43.74852726 -49.90746205 Re 22.41174813 25.49207130 21.15300231 39.37740290 45.13096518 -44.64363335 Re 22.53848316 23.95774659 22.71726984 -22.33490023 -35.21613989 -17.58822555 Re 20.95789336 25.38825682 22.04332575 -56.83098236 36.59601352 45.59042983 Re 24.19178619 24.17895518 21.29140871 -37.93552992 -13.73723829 -107.33605618 Re 25.61455359 25.53253581 21.14904689 20.57645545 27.21665309 -17.83666921 Re 25.28091226 24.10609294 22.46603997 95.77498126 -12.30508885 32.37709851 Re 23.68688212 25.32157598 22.51361598 7.96014066 75.74233602 15.59541271 Re 20.85198705 20.97567541 24.06329927 -44.03880696 -23.78218305 -14.34291938 Re 22.29882101 22.27846858 24.05286963 17.12828467 23.65993262 -12.60878230 Re 22.34126820 20.84140700 25.31668137 13.69988752 -39.92069931 28.72221620 Re 20.91986395 22.24396547 25.59073906 -23.34181935 19.94468667 29.27368563 Re 24.27219963 20.93381326 24.13132919 -29.05390567 -28.58702908 10.96396141 Re 25.75978669 22.22592512 23.78504734 55.57673960 67.76978467 64.80226439 Re 25.68365717 20.94934360 25.58343331 14.31969092 -7.40353036 18.74890864 Re 23.77778834 22.36811319 25.72094491 6.27066884 10.30205108 20.18621247 Re 21.23171545 24.18190327 24.02253701 -67.99651703 -35.32203922 -19.93173265 Re 22.41562212 25.42485375 24.12990665 18.32752344 74.53542056 -21.92238877 Re 22.28220450 24.28278197 25.56210000 58.68796633 -92.45905369 48.43214807 Re 21.13362859 25.32702941 25.57034430 -90.14759593 78.50435303 34.01088652 Re 24.04852473 24.05473499 23.91561068 -10.23472756 -25.75930725 23.22509753 Re 25.63661615 25.40480033 23.77804670 24.38792551 37.64545026 5.65220107 Re 25.29869006 24.11041876 25.26735611 38.15484875 -20.25876870 30.67446613 Re 23.83533445 25.24148635 25.58611608 13.89819148 38.16215124 29.13089534