data_generated_by_bilbao_crystallographic_server

_cell_length_a                   7.071068 
_cell_length_b                   7.071068 
_cell_length_c                   8.660254 
_cell_angle_alpha                90.000000 
_cell_angle_beta                 90.000000 
_cell_angle_gamma                120.000000        
_symmetry_space_group_name_H-M   'R-3m' 
_symmetry_Int_Tables_number      166 

loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1    'x,y,z'
2    '-y,x-y,z'
3    '-x+y,-x,z'
4    'y,x,-z'
5    'x-y,-y,-z'
6    '-x,-x+y,-z'
7    '-x,-y,-z'
8    'y,-x+y,-z'
9    'x-y,x,-z'
10   '-y,-x,z'
11   '-x+y,y,z'
12   'x,x-y,z'
13   'x+2/3,y+1/3,z+1/3'
14   '-y+2/3,x-y+1/3,z+1/3'
15   '-x+y+2/3,-x+1/3,z+1/3'
16   'y+2/3,x+1/3,-z+1/3'
17   'x-y+2/3,-y+1/3,-z+1/3'
18   '-x+2/3,-x+y+1/3,-z+1/3'
19   '-x+2/3,-y+1/3,-z+1/3'
20   'y+2/3,-x+y+1/3,-z+1/3'
21   'x-y+2/3,x+1/3,-z+1/3'
22   '-y+2/3,-x+1/3,z+1/3'
23   '-x+y+2/3,y+1/3,z+1/3'
24   'x+2/3,x-y+1/3,z+1/3'
25   'x+1/3,y+2/3,z+2/3'
26   '-y+1/3,x-y+2/3,z+2/3'
27   '-x+y+1/3,-x+2/3,z+2/3'
28   'y+1/3,x+2/3,-z+2/3'
29   'x-y+1/3,-y+2/3,-z+2/3'
30   '-x+1/3,-x+y+2/3,-z+2/3'
31   '-x+1/3,-y+2/3,-z+2/3'
32   'y+1/3,-x+y+2/3,-z+2/3'
33   'x-y+1/3,x+2/3,-z+2/3'
34   '-y+1/3,-x+2/3,z+2/3'
35   '-x+y+1/3,y+2/3,z+2/3'
36   'x+1/3,x-y+2/3,z+2/3'

loop_
_atom_site_label 
_atom_site_type_symbol 
_atom_site_symmetry_multiplicity 
_atom_site_Wyckoff_symbol 
_atom_site_fract_x 
_atom_site_fract_y 
_atom_site_fract_z 
Ba1  Ba ? ?  0.00000  0.00000  0.00000
Ti2  Ti ? ?  0.00000  0.00000  0.50000
O3    O ? ?  0.16667  0.83333  0.33333
