16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=6731.392489030366 pbc="F F F" Lu 0.29237307 -0.29782103 0.35471472 71 -1528.52923324 -1599.47702820 -947.36275689 Lu 1.54611006 1.33564454 1.43225639 71 -429.24703601 315.59206248 3067.13095815 Lu 2.81698367 0.13384964 -0.19330480 71 1091.27089447 -942.24527579 -1227.29043633 Lu 4.62456330 1.16331195 1.72436877 71 528.17851622 -204.66773901 -549.21729984 Lu 0.27602598 2.73317306 -0.01020692 71 -1467.27873763 860.23920033 -1106.37890278 Lu 1.54340337 4.61890393 1.74147255 71 218.83733163 1096.51698872 -1128.97355111 Lu 2.81729724 2.83560103 0.22477608 71 1834.49787040 1484.56590080 -1518.88206086 Lu 4.48029153 4.58768318 1.60010061 71 301.58771877 256.65915881 -305.73114161 Lu -0.04342902 0.15736241 3.28170656 71 -2207.18087899 -1768.76623358 -1715.48953414 Lu 1.21503727 1.34911615 4.72732122 71 1616.79924777 1436.35155190 2494.20668094 Lu 2.58851391 -0.21883845 3.02387628 71 687.50254527 -1027.21543860 496.79678528 Lu 4.44505970 1.66709477 4.26654355 71 6231.86962344 -5168.27791347 5399.08024574 Lu 0.11712431 3.10934253 3.08024846 71 -3402.31545140 -2109.90387975 -1518.24073327 Lu 1.64457855 4.26742755 4.20936862 71 744.72144811 3443.31242742 3777.46301104 Lu 3.08031985 2.79499696 3.18286832 71 -5815.86999744 2013.39612261 -6664.34364365 Lu 4.28585783 4.41783889 4.27890749 71 1595.15613864 1913.92009533 1447.23237934