Ba1 Ti1 O3
1.0
4.033044 0.000000 0.000000
0.000000 4.033044 0.000000
0.000000 0.000000 4.033044
Ba Ti O
1 1 3
direct
0.000000 0.000000 0.002800 Ba
0.500000 0.500000 0.502800 Ti
0.000000 0.500000 0.502800 O
0.500000 0.000000 0.502800 O
0.500000 0.500000 0.002800 O
