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=-109.45127959776566 stress="0.0014556336705540578 1.2737520888642637e-05 9.857349560024378e-05 1.2737520888642637e-05 0.0013717975477678473 7.98336094363449e-05 9.857349560024378e-05 7.98336094363449e-05 0.0015351592987005401" free_energy=-109.45127959776566 pbc="F F F" C 20.85540510 21.11115480 21.11044915 3.54324957 4.36860616 4.44441300 C 22.70960170 22.31143450 20.83833517 1.30307844 -3.56194881 2.47198367 C 22.28829595 20.83509776 22.67410596 -1.54673065 3.68560752 0.11045354 C 20.77812781 22.51878885 22.32834452 1.60148037 -2.80894149 -2.24003554 C 23.87679405 20.95894820 21.20259391 -0.55362887 6.71168952 2.19947030 C 25.56504129 22.20865944 20.86550211 -3.74502632 -2.20461309 3.19993803 C 25.28802619 21.22277084 22.68584377 -3.25816018 5.27418564 1.12849516 C 24.18362810 22.69581920 22.67283945 2.06656736 2.38353727 1.24735767 C 21.26959405 24.17626233 20.85402479 3.33326507 2.62695317 5.73141120 C 22.70996341 25.49207130 21.15300231 -0.86970460 -3.25431228 4.38238806 C 22.26177966 23.92150095 22.32435701 -2.42693215 -0.40408286 0.39630911 C 20.95789336 25.38825682 22.27041603 3.10793234 -4.25316920 -1.42999470 C 24.19178619 24.17895518 21.29140871 2.38841066 0.86627652 4.54461389 C 25.61455359 25.53253581 21.14904689 -2.35593844 -2.10912515 2.03463679 C 25.28091226 24.10609294 22.46603997 -4.68505653 1.35533327 1.29724725 C 23.80598025 25.32157598 22.26921314 -1.89906608 -2.70508689 -3.16664458 C 20.85198705 20.97567541 24.06329927 3.84928170 2.60229743 2.00291713 C 22.43745442 22.27846858 23.69629901 1.24807784 -1.94526481 -3.31754193 C 22.34126820 20.84140700 25.31668137 -1.88084110 4.63444918 -1.69631456 C 20.91986395 22.24396547 25.59073906 2.94675003 -3.07880199 -3.48164350 C 24.27219963 20.93381326 24.13132919 1.61744996 1.81389219 1.35079143 C 25.75978669 22.22592512 23.78504734 -2.48141087 -3.48254398 -1.05595602 C 25.68365717 21.20288723 25.58343331 -3.48363151 2.38508759 -3.99303962 C 23.79585403 22.44809454 25.72094491 1.89380424 -2.19199104 -2.68339071 C 21.23171545 24.18190327 23.82183498 4.04290014 1.05185114 -2.52422049 C 22.71219253 25.42485375 24.42865492 4.42843852 -4.74013463 4.08504104 C 22.05511422 24.28278197 25.44300187 -2.02151194 2.96563611 -2.69673543 C 21.13362859 25.32702941 25.57034430 1.57771808 -1.73527776 -0.52892726 C 24.04852473 24.05473499 23.91561068 2.66192789 1.95725021 -1.29305638 C 25.63661615 25.40480033 23.73856164 -2.49987563 -5.96051159 -0.44464769 C 25.29869006 24.11041876 25.26735611 -7.07708734 3.11828698 -4.43069779 C 23.83533445 25.24148635 25.58611608 -0.82572999 -3.36513434 -5.64462106