data_La2MnAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.32
_cell_length_b   6.32
_cell_length_c   6.32
_cell_angle_alpha   147.79
_cell_angle_beta   134.43
_cell_angle_gamma   56.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2MnAu
_chemical_formula_sum   'La2 Mn1 Au1'
_cell_volume   95.27
_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  La1  1  0.0  0.0  0.94  1.0
  La  La2  1  0.75  0.0  0.27  1.0
  Mn  Mn3  1  0.0  0.0  0.81  1.0
  Au  Au0  1  0.0  0.45  0.21  1.0

data_La2MnAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   4.89
_cell_length_c   6.32
_cell_angle_alpha   112.79
_cell_angle_beta   106.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2MnAu
_chemical_formula_sum   'La2 Mn1 Au1'
_cell_volume   95.27
_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  0.0  0.27  0.52  1.0
  La  La1  1  0.0  0.94  0.94  1.0
  Mn  Mn2  1  0.0  0.81  0.81  1.0
  Au  Au3  1  0.55  0.76  0.76  1.0

La La Mn Au