# generated using pymatgen
data_KTb3F12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89363739
_cell_length_b   6.89363739
_cell_length_c   6.89363739
_cell_angle_alpha   108.91370176
_cell_angle_beta   108.91370176
_cell_angle_gamma   110.59210653
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTb3F12
_chemical_formula_sum   'K1 Tb3 F12'
_cell_volume   252.11486893
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  K  K0  1  0.00000000  0.00000000  0.00000000  1.0
  Tb  Tb1  1  0.25000000  0.75000000  0.50000000  1.0
  Tb  Tb2  1  0.50000000  0.50000000  0.00000000  1.0
  Tb  Tb3  1  0.75000000  0.25000000  0.50000000  1.0
  F  F4  1  0.55443300  0.34441300  0.24715900  1.0
  F  F5  1  0.30727300  0.55443300  0.21002000  1.0
  F  F6  1  0.34441300  0.09725400  0.78998000  1.0
  F  F7  1  0.09725400  0.30727300  0.75284100  1.0
  F  F8  1  0.34171400  0.01335800  0.35507200  1.0
  F  F9  1  0.98664200  0.34171400  0.32835600  1.0
  F  F10  1  0.01335800  0.65828600  0.67164400  1.0
  F  F11  1  0.65828600  0.98664200  0.64492800  1.0
  F  F12  1  0.90274600  0.69272700  0.24715900  1.0
  F  F13  1  0.65558700  0.90274600  0.21002000  1.0
  F  F14  1  0.69272700  0.44556700  0.78998000  1.0
  F  F15  1  0.44556700  0.65558700  0.75284100  1.0