[CIF]
data_LaZr2Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48447578
_cell_length_b   4.48447578
_cell_length_c   4.35448538
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   101.14448000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaZr2Fe
_chemical_formula_sum   'La1 Zr2 Fe1'
_cell_volume   85.91964452
_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
  Fe  Fe0  1  -0.00000000  -0.00000000  0.00000000  1
  La  La1  1  2.84811223  0.00000000  0.00000000  1
  Zr  Zr2  1  1.42405611  -1.73196274  2.17724269  1
  Zr  Zr3  1  1.42405611  1.73196274  2.17724269  1
[/CIF]
