data_LaMn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88
_cell_length_b   5.88
_cell_length_c   4.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMn2
_chemical_formula_sum   'La2 Mn4'
_cell_volume   129.85
_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  0.94  0.7  0.0  1.0
  La  La1  1  0.0  0.39  0.0  1.0
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Mn  Mn3  1  0.26  0.28  0.17  1.0
  Mn  Mn4  1  0.2  0.81  0.17  1.0
  Mn  Mn5  1  0.48  0.0  0.17  1.0

data_LaMn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.34
_cell_length_b   5.88
_cell_length_c   5.88
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMn2
_chemical_formula_sum   'La2 Mn4'
_cell_volume   129.85
_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  0.0  -0.0  0.39  1.0
  La  La1  1  0.0  0.94  0.7  1.0
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Mn  Mn3  1  0.17  0.2  0.81  1.0
  Mn  Mn4  1  0.17  0.26  0.28  1.0
  Mn  Mn5  1  0.17  0.48  0.0  1.0

La La Mn Mn Mn Mn