data_Sc2NiPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.28
_cell_length_b   6.28
_cell_length_c   6.28
_cell_angle_alpha   38.14
_cell_angle_beta   38.14
_cell_angle_gamma   38.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2NiPt
_chemical_formula_sum   'Sc2 Ni1 Pt1'
_cell_volume   84.86
_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  Sc2  1  0.0  0.0  0.89  1.0
  Sc  Sc3  1  0.0  0.0  0.75  1.0
  Ni  Ni0  1  0.0  0.0  0.95  1.0
  Pt  Pt1  1  0.0  0.0  0.03  1.0

data_Sc2NiPt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.11
_cell_length_b   4.1
_cell_length_c   6.28
_cell_angle_alpha   90.0
_cell_angle_beta   112.17
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Sc2NiPt
_chemical_formula_sum   'Sc4 Ni2 Pt2'
_cell_volume   169.72
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.11  1.0
  Sc  Sc1  2  0.0  0.0  0.25  1.0
  Ni  Ni2  2  0.0  0.0  0.05  1.0
  Pt  Pt3  2  0.0  0.0  0.97  1.0

Sc Sc Ni Pt