data_BTe2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.72
_cell_length_b   6.72
_cell_length_c   6.72
_cell_angle_alpha   32.34
_cell_angle_beta   32.34
_cell_angle_gamma   32.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BTe2Pt
_chemical_formula_sum   'B1 Te2 Pt1'
_cell_volume   77.25
_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
  B  B0  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.0  0.0  0.18  1.0
  Te  Te3  1  0.0  0.0  0.92  1.0
  Pt  Pt1  1  0.0  0.0  0.55  1.0

data_BTe2Pt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.48
_cell_length_b   3.74
_cell_length_c   6.72
_cell_angle_alpha   90.0
_cell_angle_beta   108.76
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BTe2Pt
_chemical_formula_sum   'B2 Te4 Pt2'
_cell_volume   154.5
_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
  B  B0  2  0.0  0.0  0.0  1.0
  Te  Te1  2  0.0  0.0  0.08  1.0
  Te  Te2  2  0.0  0.0  0.82  1.0
  Pt  Pt3  2  0.0  0.0  0.45  1.0

B Te Te Pt
B Te Te Pt 0 2 o o - 0 1 o o o 1 3 o o o 2 3 o o o 