Anatase
1
5.419 0 0
2.82969839750231643578 4.62151143882310675002 0
-4.12434919875115821789 -2.31075571941155337501  2.6487190662596653754
Ti   O
2    4
Direct
0.75000  0.25000  0.5
0.00000  0.00000  0.0
0.95822  0.45822  0.5
0.79178  0.79178  0.0
0.54178  0.04178  0.5
0.20822  0.20822  0.0