180 Lattice="13.119838893419999 0.0 0.0 0.0 13.119838893419999 0.0 0.0 0.0 43.7327963114" Properties=species:S:1:pos:R:3:forces:R:3 energy=-195.219582551 stress="0.001172703188391347 1.5218397360702723e-11 2.84645767837184e-07 1.5218397360702723e-11 0.0011727032528955634 -1.4152876808762723e-06 2.84645767837184e-07 -1.4152876808762723e-06 -4.156724390354943e-08" pbc="T T F" Na -0.00086905 0.01134811 -0.12076894 0.00000467 -0.00000827 0.00000116 Na 2.18577516 2.19797752 2.20416139 0.00000490 -0.00000822 0.00000081 Na -0.00085291 0.01131877 4.37958970 0.00000353 -0.00000741 0.00000018 Na 2.18580103 2.19793105 6.56734332 0.00000268 -0.00000643 -0.00000016 Na -0.00082065 0.01125369 8.75387498 0.00000132 -0.00000452 -0.00000014 Na 2.18583795 2.19785375 10.94052637 0.00000034 -0.00000380 0.00000001 Na -0.00078222 0.01116864 13.12716708 -0.00000080 -0.00000214 -0.00000061 Na 2.18587521 2.19776057 15.31380842 -0.00000162 -0.00000109 -0.00000108 Na -0.00074674 0.01107110 17.50044927 -0.00000287 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