data_NbPt4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   99.4
_cell_angle_beta   99.4
_cell_angle_gamma   132.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbPt4
_chemical_formula_sum   'Nb1 Pt4'
_cell_volume   79.65
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.88  0.65  0.98  1.0
  Pt  Pt2  1  0.82  0.29  0.0  1.0
  Pt  Pt3  1  0.29  0.52  0.0  1.0
  Pt  Pt4  1  0.35  0.88  0.98  1.0

data_NbPt4
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.96
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   80.6
_cell_angle_beta   66.17
_cell_angle_gamma   66.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbPt4
_chemical_formula_sum   'Nb1 Pt4'
_cell_volume   79.65
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.29  -0.0  0.53  1.0
  Pt  Pt2  1  0.52  -0.0  0.77  1.0
  Pt  Pt3  1  0.67  0.98  0.23  1.0
  Pt  Pt4  1  0.9  0.98  0.47  1.0

Nb Pt Pt Pt Pt