data_TaMn2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73
_cell_length_b   4.73
_cell_length_c   4.73
_cell_angle_alpha   137.44
_cell_angle_beta   128.26
_cell_angle_gamma   69.16
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMn2Pd
_chemical_formula_sum   'Ta1 Mn2 Pd1'
_cell_volume   55.21
_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
  Ta  Ta3  1  0.0  0.06  0.05  1.0
  Mn  Mn0  1  0.0  0.0  0.17  1.0
  Mn  Mn1  1  0.72  0.0  0.74  1.0
  Pd  Pd2  1  0.0  0.0  0.83  1.0

data_TaMn2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   4.13
_cell_length_c   4.73
_cell_angle_alpha   115.87
_cell_angle_beta   111.28
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMn2Pd
_chemical_formula_sum   'Ta1 Mn2 Pd1'
_cell_volume   55.21
_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
  Ta  Ta0  1  0.94  0.98  0.98  1.0
  Mn  Mn1  1  0.0  0.17  0.17  1.0
  Mn  Mn2  1  0.0  0.74  0.03  1.0
  Pd  Pd3  1  0.0  0.83  0.83  1.0

Ta Mn Mn Pd