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=-38.16855410153188 stress="-0.0010296633321254965 7.405436027411725e-05 7.439959580783454e-05 7.405436027411725e-05 -0.0008509415200977912 -0.00026578784066475674 7.439959580783454e-05 -0.00026578784066475674 -0.0009264062577279615" pbc="F F F" Au 20.91870436 21.04860922 21.20118821 -0.75458724 -0.43832675 -0.51584856 Au 22.70960170 22.31143450 22.33833517 -4.01754318 4.95214959 2.10550022 Au 23.78829595 20.83509776 21.14041416 3.63360199 -6.08175540 -5.14407037 Au 25.27812781 22.79098848 22.26215777 5.69102554 -2.69770344 1.36044662 Au 20.87679405 24.09027739 21.46238060 -6.16640607 -3.57768619 -3.16537761 Au 22.56504129 25.20865944 22.36550211 -12.68943902 19.95945649 12.35085590 Au 23.78802619 24.22277084 21.18584377 13.01203259 -7.52716682 -19.68667440 Au 25.40955323 25.48086654 22.83050726 2.52370106 2.19594946 -0.13007563 Au 21.26959405 21.37914956 23.93745809 -6.19886482 -4.89916492 -1.37876714 Au 22.50581744 22.44016584 25.47483729 4.21389465 0.42769874 6.32486785 Au 24.25067569 20.95774659 23.84337532 0.78611495 -1.43615822 1.55683604 Au 25.58780002 22.17046132 25.55319800 -0.48339696 0.66252786 -0.33192142 Au 21.19178619 24.24105518 24.42503730 -7.81437227 -3.32278386 -4.51055294 Au 22.44158300 25.53253581 25.64904689 4.37534999 5.52837234 5.41071074 Au 23.78091226 24.10609294 23.96603997 4.09417763 -3.44711132 6.07781722 Au 25.37632455 25.37010071 25.56835097 -0.20528885 -0.29829756 -0.32374652