data_TcGe2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48
_cell_length_b   4.48
_cell_length_c   4.48
_cell_angle_alpha   122.89
_cell_angle_beta   122.89
_cell_angle_gamma   85.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcGe2Pt
_chemical_formula_sum   'Tc1 Ge2 Pt1'
_cell_volume   60.73
_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
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Ge  Ge0  1  0.14  0.0  0.65  1.0
  Ge  Ge1  1  0.0  0.14  0.65  1.0
  Pt  Pt2  1  0.0  0.0  0.3  1.0

data_TcGe2Pt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.06
_cell_length_b   6.06
_cell_length_c   4.48
_cell_angle_alpha   90.0
_cell_angle_beta   132.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TcGe2Pt
_chemical_formula_sum   'Tc2 Ge4 Pt2'
_cell_volume   121.46
_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
  Tc  Tc0  2  0.0  0.0  0.0  1.0
  Ge  Ge1  4  0.42  0.07  0.49  1.0
  Pt  Pt2  2  0.2  0.5  0.7  1.0

Tc Ge Ge Pt
Tc Ge Ge Pt 0 3 o o o 1 2 o o o 1 3 o o o 2 3 o o o 