BaTiO3 (PBEsol, 2x2x2, cubic)                  
   2.00000000000000     
     3.9855493692679786   -0.0000000000000000    0.0000000000000000
    -0.0000000000000000    3.9855493692679786    0.0000000000000000
    -0.0000000000000000   -0.0000000000000000    3.9855493692679786
   Ba   Ti   O 
     8    8     24
Direct
0.000000000000000 0.000000000000000 0.000000000000000
0.000000000000000 0.000000000000000 0.500000000000000
0.000000000000000 0.500000000000000 0.000000000000000
0.000000000000000 0.500000000000000 0.500000000000000
0.500000000000000 0.000000000000000 0.000000000000000
0.500000000000000 0.000000000000000 0.500000000000000
0.500000000000000 0.500000000000000 0.000000000000000
0.500000000000000 0.500000000000000 0.500000000000000
0.250000000000000 0.250000000000000 0.250000000000000
0.250000000000000 0.250000000000000 0.750000000000000
0.250000000000000 0.750000000000000 0.250000000000000
0.250000000000000 0.750000000000000 0.750000000000000
0.750000000000000 0.250000000000000 0.250000000000000
0.750000000000000 0.250000000000000 0.750000000000000
0.750000000000000 0.750000000000000 0.250000000000000
0.750000000000000 0.750000000000000 0.750000000000000
0.000000000000000 0.250000000000000 0.250000000000000
0.000000000000000 0.250000000000000 0.750000000000000
0.000000000000000 0.750000000000000 0.250000000000000
0.000000000000000 0.750000000000000 0.750000000000000
0.250000000000000 0.000000000000000 0.250000000000000
0.250000000000000 0.000000000000000 0.750000000000000
0.250000000000000 0.250000000000000 0.000000000000000
0.250000000000000 0.250000000000000 0.500000000000000
0.250000000000000 0.500000000000000 0.250000000000000
0.250000000000000 0.500000000000000 0.750000000000000
0.250000000000000 0.750000000000000 0.000000000000000
0.250000000000000 0.750000000000000 0.500000000000000
0.500000000000000 0.250000000000000 0.250000000000000
0.500000000000000 0.250000000000000 0.750000000000000
0.500000000000000 0.750000000000000 0.250000000000000
0.500000000000000 0.750000000000000 0.750000000000000
0.750000000000000 0.000000000000000 0.250000000000000
0.750000000000000 0.000000000000000 0.750000000000000
0.750000000000000 0.250000000000000 0.000000000000000
0.750000000000000 0.250000000000000 0.500000000000000
0.750000000000000 0.500000000000000 0.250000000000000
0.750000000000000 0.500000000000000 0.750000000000000
0.750000000000000 0.750000000000000 0.000000000000000
0.750000000000000 0.750000000000000 0.500000000000000
