# generated using pymatgen
data_KMg6Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40247252
_cell_length_b   6.40247252
_cell_length_c   5.09626700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000538
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KMg6Mo
_chemical_formula_sum   'K1 Mg6 Mo1'
_cell_volume   180.91652095
_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  0.33333300  0.66666700  0.00000000  1.0
  Mg  Mg1  1  0.84939400  0.69878900  0.00000000  1.0
  Mg  Mg2  1  0.84939400  0.15060600  0.00000000  1.0
  Mg  Mg3  1  0.30121100  0.15060600  0.00000000  1.0
  Mg  Mg4  1  0.50853800  0.01707700  0.50000000  1.0
  Mg  Mg5  1  0.50853800  0.49146200  0.50000000  1.0
  Mg  Mg6  1  0.98292300  0.49146200  0.50000000  1.0
  Mo  Mo7  1  0.00000000  0.00000000  0.50000000  1.0