# generated using pymatgen
data_Mg2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.23179058
_cell_length_b   6.23179058
_cell_length_c   6.23179123
_cell_angle_alpha   53.62954961
_cell_angle_beta   53.62954961
_cell_angle_gamma   53.62955600
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Sb
_chemical_formula_sum   'Mg4 Sb2'
_cell_volume   145.63135939
_cell_formula_units_Z   2
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
  Mg  Mg0  1  0.00000000  0.66014500  0.33985500  1.0
  Mg  Mg1  1  0.33985500  0.00000000  0.66014500  1.0
  Mg  Mg2  1  0.50000000  0.50000000  0.50000000  1.0
  Mg  Mg3  1  0.66014500  0.33985500  0.00000000  1.0
  Sb  Sb4  1  0.15128200  0.15128200  0.15128200  1.0
  Sb  Sb5  1  0.84871800  0.84871800  0.84871800  1.0