# generated using pymatgen
data_CsMg6Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.18326000
_cell_length_b   7.18326000
_cell_length_c   4.15018900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsMg6Nb
_chemical_formula_sum   'Cs1 Mg6 Nb1'
_cell_volume   214.14653280
_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
  Cs  Cs0  1  0.00000000  0.00000000  0.50000000  1.0
  Mg  Mg1  1  0.00000000  0.50000000  0.50000000  1.0
  Mg  Mg2  1  0.50000000  0.00000000  0.50000000  1.0
  Mg  Mg3  1  0.70702900  0.29297100  0.00000000  1.0
  Mg  Mg4  1  0.29297100  0.70702900  0.00000000  1.0
  Mg  Mg5  1  0.70702900  0.70702900  0.00000000  1.0
  Mg  Mg6  1  0.29297100  0.29297100  0.00000000  1.0
  Nb  Nb7  1  0.50000000  0.50000000  0.50000000  1.0