# generated using pymatgen
data_LaF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.14985611
_cell_length_b   4.14985587
_cell_length_c   7.32649511
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000993
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaF3
_chemical_formula_sum   'La2 F6'
_cell_volume   109.26797752
_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
  La  La0  1  0.66666700  0.33333300  0.75000000  1.0
  La  La1  1  0.33333300  0.66666700  0.25000000  1.0
  F  F2  1  0.33333300  0.66666700  0.92002846  1.0
  F  F3  1  0.66666700  0.33333300  0.42002846  1.0
  F  F4  1  -0.00000000  -0.00000000  0.25000000  1.0
  F  F5  1  -0.00000000  -0.00000000  0.75000000  1.0
  F  F6  1  0.33333300  0.66666700  0.57997154  1.0
  F  F7  1  0.66666700  0.33333300  0.07997154  1.0