Created Data
1
3.790000 3.790000 3.790000 90.000000 90.000000 90.000000
2.000000
0 0 1
1 1
5 3
1 Al 0.500000 0.500000 0.500000 0.600000 1.000000
2 O 0.500000 0.500000 0.000000 0.800000 1.000000
2 O 0.500000 0.000000 0.500000 0.800000 1.000000
2 O 0.000000 0.500000 0.500000 0.800000 1.000000
3 La 0.000000 0.000000 0.000000 0.500000 1.000000
200cx 1.200000 50.000000 0.500000
200.000000
0.000000 0.000000
98.540001
NO
-600.000000
0.700000
 0.000000 0.000000 0.000000 0.000000
x,y,z
6
0.000000