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:forces:R:3 energy=-64.10810146361906 stress="-25.019836207022422 -63.58085111999614 -35.82890632275928 -63.58085111999614 10.447834786870771 -35.26357054260268 -35.82890632275928 -35.26357054260268 -26.49880219902144" pbc="F F F" Rg 0.00461502 -0.12720650 0.03670158 2.49447170 3.59928211 3.31644717 Rg 1.38009595 1.77460150 1.72625071 13.14655807 -1.26075910 6.96597923 Rg 3.26746731 -0.19364183 -0.16272133 -0.84860380 2.88338900 3.56185283 Rg 4.61878673 1.49108564 1.55860470 -6.22698218 2.51591024 2.07666862 Rg 0.09349352 2.78141809 0.19062768 -3.04463461 4.35686020 -3.51383070 Rg 1.37875283 4.57496200 1.69065672 3.26708008 -6.71960616 1.32038695 Rg 3.14993272 3.46076534 -0.09659325 -2.29646638 -1.82949136 5.79324895 Rg 4.51670748 4.17777771 1.83951776 14.16141781 8.02593341 -14.45662555 Rg 0.25353150 0.16084163 2.95790792 -11.14242048 -10.05727123 -12.19660109 Rg 1.56440269 1.21837808 4.33569686 11.65695294 16.74364201 9.58355563 Rg 3.05947164 0.00505317 3.01522104 0.72574750 3.94319734 -4.14102942 Rg 4.34825566 1.55335210 4.64225781 -4.66846167 2.22695780 -4.86162246 Rg 0.04278481 3.16642262 3.14507653 -21.34770054 -24.50218318 -23.45609342 Rg 1.33126097 4.29471125 4.34714501 25.64291058 20.20628366 20.68320855 Rg 3.10719108 3.26324146 3.17069824 -33.87642273 -32.65323232 -5.87935771 Rg 4.22076488 4.43864783 4.56236140 12.35655370 12.52108760 15.20381242