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=1342199.039017868 stress="-79.93474302019729 3.626177617896864 -15.86513515052816 3.626177617896864 -68.11111870970366 1.4652265866334608 -15.86513515052816 1.4652265866334608 -71.80121484278384" free_energy=1342199.039017868 pbc="F F F" Gd 21.21852519 21.24089876 20.97809811 -593640.84910063 -297432.29163961 -288566.58893579 Gd 22.43421962 22.31785661 21.16518869 422390.83461322 375088.44989241 -46573.10432317 Gd 22.28619167 20.80801543 22.25091573 216349.75779784 -179946.83347389 209392.00736178 Gd 21.17661605 22.60576935 22.74194622 -191485.02016792 -128395.30435996 -202565.19838001 Gd 24.16739062 20.88626389 21.29027304 -172750.06521949 -61998.50818156 -269051.09400658 Gd 25.57341860 22.74215416 21.15367939 135330.11800875 -47041.26997935 -125433.45075992 Gd 25.24183504 20.99506391 22.62034776 420297.79781318 -439832.99968906 219038.06160728 Gd 24.38890893 22.41294224 22.53959718 -767345.04979745 244556.19012671 -297178.35385015 Gd 21.12239339 23.91926102 21.24411381 -165115.40052795 45249.26435793 -172302.81903762 Gd 22.80672416 25.66087796 21.29234648 -34930.57624065 26439.63202550 -45238.11773916 Gd 22.41463005 23.86307593 22.44886957 210045.69637723 144344.07131019 133192.02761028 Gd 20.91412221 25.65635753 22.65902135 -10855.24481646 13189.99269662 4295.99138555 Gd 23.90067437 23.72675381 21.17816572 -94599.63156650 33562.04583900 -162383.35142755 Gd 25.39195589 25.72682718 21.22371595 84509.97769181 83595.82717875 -139944.08494277 Gd 25.20409142 24.22264861 22.35183323 583642.51932988 -434259.15495114 -175890.81227303 Gd 24.22790838 25.49045384 22.63209164 -792082.32354750 698121.48560779 -437748.93127340 Gd 21.10175884 21.05304784 23.69524154 -85838.78967958 -140897.93519548 104131.78316495 Gd 22.52844980 22.48585722 23.99267850 -36134.99199286 37771.61007783 -141435.80034427 Gd 22.73648852 20.99651844 25.67285016 -256453.58626203 -237896.12225977 341913.67757998 Gd 21.29619700 22.13094407 25.40703822 -127195.17442633 52579.31539643 80049.52616057 Gd 23.72535738 20.74201195 24.29062798 94817.98006642 -295856.11027726 -378587.50957099 Gd 25.60091520 22.61468927 23.59310373 507317.41410659 121887.19846261 437916.42224112 Gd 25.33532339 21.28247263 25.13506968 177737.24868322 -65936.93859586 56853.66051098 Gd 23.79066838 22.25173197 25.15232950 272426.91755022 435223.78806291 216494.19874696 Gd 20.90082363 23.71710728 24.09242332 -67342.53164656 147829.23277949 140156.76747354 Gd 22.76627039 25.54300304 24.17982222 -119115.47442470 93825.61576530 -86418.56798277 Gd 22.91988365 24.14341125 25.43359328 -31199.21161335 -63160.16559520 89249.20128514 Gd 20.82454082 25.40430546 25.61959057 -5111.35744551 6555.77919105 7122.84699357 Gd 24.08834765 24.14106865 23.70767037 -278050.58914053 -390814.05691541 289020.68246916 Gd 25.28728592 25.39860656 23.84598062 694261.98322158 202420.66026575 338351.14207093 Gd 25.57011829 24.50220957 25.46625438 212113.41207211 -213116.64170737 113125.35001637 Gd 24.27579060 25.64007335 25.28460050 -201995.78971607 234344.17378464 189014.43816903