16 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=-18.66009022247601 stress="-0.0011608185716224229 6.514580276970393e-05 0.00020679010878618098 6.514580276970393e-05 -0.0007962758404584108 -0.0004490644234339714 0.00020679010878618098 -0.0004490644234339714 -0.0009268098851820269" pbc="F F F" Al 20.91870436 21.04860922 21.20118821 -1.57590605 -0.82852272 -1.42072027 Al 22.70960170 22.31143450 22.33833517 -1.49997647 9.06077459 4.06258931 Al 23.78829595 20.83509776 21.14041416 4.88729490 -7.17464279 -5.61894546 Al 25.27812781 22.79098848 22.26215777 4.80881015 -3.13592722 2.66574673 Al 20.87679405 24.09027739 21.46238060 -7.11254751 -4.92546746 -3.71715841 Al 22.56504129 25.20865944 22.36550211 -12.90459718 22.14606918 18.57700402 Al 23.78802619 24.22277084 21.18584377 15.73581923 -10.90457992 -22.19836024 Al 25.40955323 25.48086654 22.83050726 1.87827693 1.76781484 -0.60977424 Al 21.26959405 21.37914956 23.85402479 -4.93157078 -3.14411512 3.01945444 Al 22.79339672 22.28792533 25.60109685 -0.68363751 1.63426378 3.71119001 Al 24.25942807 20.95774659 24.15023703 -2.51817373 -4.82703922 -5.51203488 Al 25.63979664 22.21009180 25.48260856 3.46019873 4.26390873 3.13729526 Al 21.19178619 24.17895518 24.29140871 -4.49594456 -3.47563750 -2.14390882 Al 22.53940734 25.53253581 25.64904689 0.09372458 3.99794944 4.21808424 Al 23.78091226 24.10609294 24.09594663 2.31771850 -5.33031399 0.53062427 Al 25.08818475 25.60435795 25.57571598 2.54051078 0.87546539 1.29891405