20 Lattice="4.184726107936311 4.184726107936311 0.0 -4.184726107936311 4.184726107936311 0.0 0.0 0.0 8.369452215872622" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-142.05635944289304 pbc="T T T" K 0.00026608 0.00081174 -0.00005072 0.00000000 Nb 2.09240853 2.09258374 2.09239918 0.00000000 O 2.09257346 2.09307587 0.02953980 0.00000000 O 0.03240855 2.09332924 2.09168151 0.00000000 O -2.09226755 4.21721897 2.09236129 0.00000000 Ba -0.00047144 4.18526772 0.00069840 0.00000000 Sn 2.09235036 6.27707984 2.09247220 0.00000000 O 2.09235891 6.27737128 -0.02956754 0.00000000 O -0.03240588 6.27683587 2.09223030 0.00000000 O 2.09226031 4.15243623 2.09236180 0.00000000 Ba 0.00053683 0.00081756 4.18528373 0.00000000 Sn 2.09275058 2.09588888 6.27700482 0.00000000 O 2.09243175 2.09307791 4.15510102 0.00000000 O -0.03193119 2.09353449 6.27723059 0.00000000 O -2.08268394 4.15836942 6.27722170 0.00000000 K -0.00023620 4.18535993 4.18459437 0.00000000 Nb 2.09291845 6.28263635 6.27713715 0.00000000 O 2.09245470 6.27737343 4.21417427 0.00000000 O 0.03321809 6.29493173 6.27676024 0.00000000 O 2.08291349 4.22185745 6.27722081 0.00000000