# generated using pymatgen
data_YMg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85325353
_cell_length_b   5.85325353
_cell_length_c   6.48405190
_cell_angle_alpha   64.47495635
_cell_angle_beta   64.47495635
_cell_angle_gamma   60.48831034
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMg
_chemical_formula_sum   'Y3 Mg3'
_cell_volume   167.55815327
_cell_formula_units_Z   3
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
  Y  Y0  1  0.35288300  0.64711700  0.00000000  1.0
  Y  Y1  1  0.82859100  0.84498400  0.48786100  1.0
  Y  Y2  1  0.15501600  0.17140900  0.51213900  1.0
  Mg  Mg3  1  0.00024700  0.33418600  0.00373700  1.0
  Mg  Mg4  1  0.66581400  0.99975300  0.99626300  1.0
  Mg  Mg5  1  0.49744900  0.50255100  0.50000000  1.0