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=-123.39025390138433 pbc="F F F" As 0.27544140 -0.24837367 0.28148913 33 4.89092651 7.18822621 5.68078913 As 1.55210001 1.46864501 1.76147517 33 9.10387955 9.71961510 -37.07368396 As 3.30476879 0.00505582 -0.26405180 33 -2.33931914 7.72532627 8.00711627 As 4.67858111 1.58352372 1.34376228 33 -8.13570135 -3.59542461 7.11620004 As -0.23179438 2.73765601 0.26111147 33 8.46809741 -2.79615090 9.43554841 As 1.79963372 4.47927008 1.22147108 33 0.83768934 -9.18806435 6.09979607 As 3.19736496 2.90306549 0.13856038 33 -5.24568426 -2.26047541 5.19267326 As 4.49965461 4.77820060 1.09380754 33 -7.10262819 -6.43536083 2.26664438 As 0.17621204 0.13215382 2.71035018 33 -19.27814614 -17.91083678 15.84127936 As 1.32314650 1.22116025 4.61719846 33 4.89813737 4.42966955 -13.54603125 As 3.27680686 0.09967038 2.99640474 33 -8.55885089 10.08950903 -6.72485626 As 4.56224969 1.34915582 4.49458504 33 -4.25650453 5.57582166 -3.57710217 As -0.23013858 3.13236414 2.91175620 33 13.45473553 -5.60382689 -4.23713503 As 1.64278722 4.30772007 4.53790681 33 0.95007531 -5.93513567 -6.27727888 As 2.73395044 2.71647147 3.07493195 33 17.31317316 13.10144858 15.17329321 As 4.63169046 4.77607492 4.35287479 33 -4.99987968 -4.10434096 -3.37725259