data_ZrTePt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15
_cell_length_b   5.15
_cell_length_c   4.57
_cell_angle_alpha   98.72
_cell_angle_beta   98.72
_cell_angle_gamma   42.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTePt2
_chemical_formula_sum   'Zr1 Te1 Pt2'
_cell_volume   80.36
_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
  Zr  Zr3  1  0.87  0.0  0.95  1.0
  Te  Te2  1  0.28  0.0  0.22  1.0
  Pt  Pt0  1  0.09  0.0  0.01  1.0
  Pt  Pt1  1  0.05  0.0  0.6  1.0

data_ZrTePt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.71
_cell_length_b   4.57
_cell_length_c   5.15
_cell_angle_alpha   98.72
_cell_angle_beta   111.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTePt2
_chemical_formula_sum   'Zr1 Te1 Pt2'
_cell_volume   80.36
_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
  Zr  Zr0  1  0.0  0.95  0.87  1.0
  Te  Te1  1  0.0  0.22  0.28  1.0
  Pt  Pt2  1  0.0  0.01  0.09  1.0
  Pt  Pt3  1  0.0  0.6  0.05  1.0

Zr Te Pt Pt