data_ScMn2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12
_cell_length_b   5.12
_cell_length_c   5.12
_cell_angle_alpha   143.97
_cell_angle_beta   133.24
_cell_angle_gamma   60.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMn2Pd
_chemical_formula_sum   'Sc1 Mn2 Pd1'
_cell_volume   57.09
_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
  Sc  Sc3  1  0.0  0.0  0.0  1.0
  Mn  Mn0  1  0.0  0.03  0.22  1.0
  Mn  Mn1  1  0.58  0.0  0.21  1.0
  Pd  Pd2  1  0.0  0.0  0.43  1.0

data_ScMn2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   4.07
_cell_length_c   5.12
_cell_angle_alpha   113.38
_cell_angle_beta   108.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMn2Pd
_chemical_formula_sum   'Sc1 Mn2 Pd1'
_cell_volume   57.09
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Mn  Mn1  1  0.0  0.21  0.62  1.0
  Mn  Mn2  1  0.97  0.19  0.19  1.0
  Pd  Pd3  1  0.0  0.43  0.43  1.0

Sc Mn Mn Pd