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=-18.751328966919843 stress="-0.00019611630695826185 -0.00019325776079884063 -8.526363888575471e-05 -0.00019325776079884063 -0.00022937044491406583 -9.882862634868915e-06 -8.526363888575471e-05 -9.882862634868915e-06 -0.0002937060694752179" free_energy=-18.751328966919843 pbc="F F F" O 21.00642723 21.05525431 21.15346794 0.58641402 0.66495094 0.25874242 Au 22.58442254 22.45525223 22.39016040 -7.99103067 -3.04701774 -0.31547158 O 23.81963533 20.91286074 20.88545572 0.18197974 0.93163959 0.61449484 Au 25.75278033 22.40903348 22.31967904 0.38976054 -0.90681967 0.29650022 O 20.99796850 24.02606635 21.00180280 0.63175048 -0.44784104 -0.09943166 O 22.50232551 25.67283051 22.77093457 0.24258606 -0.28221411 0.04966829 Au 23.78902040 23.73155877 20.92113482 2.90220627 4.39014124 -5.30531675 O 25.21620371 25.38477302 22.56194135 -0.28205794 -0.82732164 1.67383533 O 20.90184239 20.76501852 23.68340212 0.79669010 0.22281152 0.33506123 Au 22.49454085 22.81016920 25.35019061 -2.55432782 0.96136382 1.29317182 Au 23.66990847 20.91062519 23.89175758 1.86109267 -4.22300592 1.54605386 Au 25.64332596 22.22950407 25.29998375 0.31314223 0.67416321 0.43687751 O 21.23232047 24.14379487 23.99596198 0.88309374 -1.36300456 0.71796648 O 22.73672153 25.64759855 25.40527573 1.27614261 -0.24939747 0.49480426 Au 24.04132417 24.25912702 23.84677847 -7.04660379 -3.57589482 -8.32060767 Au 25.35844045 25.41738309 24.98497289 7.80916175 7.07744667 6.32365139