data_LaMg2Zn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.29
_cell_length_b   4.71
_cell_length_c   6.59
_cell_angle_alpha   90.0
_cell_angle_beta   103.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMg2Zn
_chemical_formula_sum   'La1 Mg2 Zn1'
_cell_volume   99.11
_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
  La  La0  1  0.79  0.36  0.55  1.0
  Mg  Mg1  1  0.12  0.0  0.38  1.0
  Mg  Mg2  1  0.52  0.36  0.56  1.0
  Zn  Zn3  1  0.41  0.0  0.1  1.0

data_LaMg2Zn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   4.71
_cell_length_c   6.59
_cell_angle_alpha   90.0
_cell_angle_beta   103.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMg2Zn
_chemical_formula_sum   'La1 Mg2 Zn1'
_cell_volume   99.11
_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
  La  La0  1  0.79  0.36  0.55  1.0
  Mg  Mg1  1  0.12  0.0  0.38  1.0
  Mg  Mg2  1  0.52  0.36  0.56  1.0
  Zn  Zn3  1  0.41  0.0  0.1  1.0

La Mg Mg Zn