data_TaAgP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.22
_cell_length_b   4.22
_cell_length_c   3.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAgP
_chemical_formula_sum   'Ta1 Ag1 P1'
_cell_volume   54.37
_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
  Ta  Ta2  1  0.11  0.22  0.0  1.0
  Ag  Ag0  1  1.0  0.43  0.77  1.0
  P  P1  1  0.0  0.0  0.0  1.0

data_TaAgP
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.53
_cell_length_b   4.22
_cell_length_c   4.22
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAgP
_chemical_formula_sum   'Ta1 Ag1 P1'
_cell_volume   54.37
_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
  Ta  Ta0  1  -0.0  0.11  0.22  1.0
  Ag  Ag1  1  0.77  1.0  0.43  1.0
  P  P2  1  0.0  0.0  0.0  1.0

Ta Ag P