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=3000.9728862162483 stress="-0.061929132699100845 0.00016245143953477618 -0.0010481766676009778 0.00016245143953477618 -0.0558960503657066 -0.00047092691530189475 -0.0010481766676009778 -0.00047092691530189475 -0.059919726616799424" free_energy=3000.9728862162483 pbc="F F F" Br 20.85540510 21.11115480 21.11044915 -93.19886171 -89.76309611 -109.35023254 Br 22.70960170 22.34512630 20.83833517 -16.25372061 34.14798825 -143.65636796 Br 22.31428531 20.83509776 22.36371066 -18.33405060 -139.87490708 38.13954152 Br 20.77812781 22.48254321 22.23417995 -122.30509187 47.75229934 33.64501864 Br 23.63239121 20.95894820 21.20259391 71.62586406 -131.23713857 -91.89648342 Br 25.56504129 21.91044416 20.86550211 77.35269513 4.38013820 -102.31075166 Br 25.28802619 21.22277084 22.68584377 94.11094356 -169.96914968 -103.61420131 Br 24.18362810 22.69581920 22.94559836 -10.06603410 -39.34113887 -65.24273940 Br 21.26959405 24.17626233 20.85402479 -112.12905795 -29.57090901 -162.49464045 Br 22.70996341 25.49207130 21.15300231 -26.45141255 181.74623251 -158.10815386 Br 22.53848316 23.95774659 22.19143129 -78.30659311 -67.83521809 50.48109666 Br 20.95789336 25.38825682 22.15131790 -128.82991882 116.07825064 43.14171363 Br 24.05315278 24.17895518 21.29140871 17.84032789 -72.68755339 -247.02269137 Br 25.61455359 25.53253581 21.14904689 96.95467566 114.70672638 -101.24563310 Br 25.28091226 24.16444828 22.21249634 225.18707788 -60.34217658 3.34355768 Br 23.78791456 25.32157598 22.51361598 19.25362625 220.85367221 55.34814467 Br 20.85198705 20.97567541 23.98331792 -110.04735053 -78.47820842 -9.76587128 Br 22.63815645 22.27846858 23.69794387 -67.58871651 3.08829717 41.41803534 Br 22.34126820 20.84140700 25.31668137 13.88024534 -114.02710731 84.78755615 Br 20.91986395 22.24396547 25.59073906 -84.48794144 24.22288449 85.08862532 Br 24.27219963 20.93381326 24.13132919 -38.55131824 -158.20956923 55.88425224 Br 25.75978669 22.22592512 23.78504734 199.30912797 67.57987949 76.52089012 Br 25.68365717 21.20288723 25.58343331 70.54242406 -46.36061341 96.41908743 Br 23.69670569 22.44603001 25.72094491 10.20735573 -1.11554200 118.41373027 Br 21.23171545 24.18190327 24.10370736 -146.17992927 -48.42624370 -66.46095471 Br 22.71219253 25.42485375 24.13991858 -30.67985150 174.99892290 -40.93952621 Br 22.26673789 24.28278197 25.56210000 33.40367938 -113.92865389 156.84696342 Br 21.13362859 25.32702941 25.57034430 -157.71394698 148.53739549 96.89140183 Br 24.15022594 24.05473499 23.91561068 -12.79380385 -2.37091182 63.50525258 Br 25.63661615 25.40480033 23.75512869 124.36857147 126.18676753 27.72405796 Br 25.29869006 24.11041876 25.26735611 142.10518565 -24.85264321 129.55165025 Br 23.83533445 25.24148635 25.58611608 57.77579964 124.11132576 144.95767155