Ba1 Ti1 O3
1.0
4.026005 0.000000 0.000000
0.000000 4.026005 0.000000
0.000000 0.000000 4.073644
Ba Ti O
1 1 3
direct
0.000000 0.000000 0.006683 Ba
0.500000 0.500000 0.510812 Ti
0.000000 0.500000 0.500405 O
0.500000 0.000000 0.500405 O
0.500000 0.500000 0.995695 O
