data_YTa2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   3.11
_cell_length_c   8.39
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTa2P
_chemical_formula_sum   'Y1 Ta2 P1'
_cell_volume   78.04
_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
  Y  Y3  1  0.87  0.0  0.96  1.0
  Ta  Ta1  1  0.87  0.0  0.22  1.0
  Ta  Ta2  1  0.0  0.0  0.51  1.0
  P  P0  1  0.0  0.0  0.89  1.0

data_YTa2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   3.11
_cell_length_c   8.39
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTa2P
_chemical_formula_sum   'Y1 Ta2 P1'
_cell_volume   78.04
_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
  Y  Y0  1  0.87  0.0  0.96  1.0
  Ta  Ta1  1  0.0  0.0  0.51  1.0
  Ta  Ta2  1  0.87  0.0  0.22  1.0
  P  P3  1  0.0  0.0  0.89  1.0

Y Ta Ta P
Y Ta Ta P 0 3 + o o 0 1 o o + 1 2 + o o 2 2 o + o 2 2 + o o 2 3 o o o 