# generated using pymatgen
data_SmMgF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.82804800
_cell_length_b   5.79968400
_cell_length_c   8.05607386
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.74420764
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmMgF4
_chemical_formula_sum   'Sm2 Mg2 F8'
_cell_volume   173.73530685
_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
  Sm  Sm0  1  0.67855000  0.25000000  0.35710000  1.0
  Sm  Sm1  1  0.32145000  0.75000000  0.64290000  1.0
  Mg  Mg2  1  0.07967000  0.75000000  0.15934000  1.0
  Mg  Mg3  1  0.92033000  0.25000000  0.84066000  1.0
  F  F4  1  0.00000000  0.00000000  0.00000000  1.0
  F  F5  1  0.00000000  0.50000000  0.00000000  1.0
  F  F6  1  0.19265700  0.51053400  0.38531400  1.0
  F  F7  1  0.80734300  0.48946600  0.61468600  1.0
  F  F8  1  0.38952400  0.25000000  0.77904800  1.0
  F  F9  1  0.61047600  0.75000000  0.22095200  1.0
  F  F10  1  0.19265700  0.98946600  0.38531400  1.0
  F  F11  1  0.80734300  0.01053400  0.61468600  1.0