[CIF]
data_MgSb2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.48951210
_cell_length_b   8.48951210
_cell_length_c   8.48951210
_cell_angle_alpha   26.02884172
_cell_angle_beta   26.02884172
_cell_angle_gamma   26.02884172
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSb2Se
_chemical_formula_sum   'Mg1 Sb2 Se1'
_cell_volume   103.79065525
_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
  Mg  Mg0  1  -0.00000000  -0.00000000  -0.00000000  1
  Sb  Sb1  1  -0.00000000  -0.00000000  6.07672426  1
  Sb  Sb2  1  -0.00000000  0.00000000  18.51567877  1
  Se  Se3  1  0.00000000  0.00000000  12.29620151  1
[/CIF]
