data_YFe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42
_cell_length_b   5.42
_cell_length_c   3.47
_cell_angle_alpha   108.3
_cell_angle_beta   108.3
_cell_angle_gamma   120.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YFe2P
_chemical_formula_sum   'Y1 Fe2 P1'
_cell_volume   67.8
_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  0.68  0.0  0.0  1.0
  Fe  Fe0  1  0.24  0.64  0.34  1.0
  Fe  Fe1  1  0.24  0.36  0.34  1.0
  P  P2  1  0.0  0.0  0.0  1.0

data_YFe2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.47
_cell_length_b   4.15
_cell_length_c   5.42
_cell_angle_alpha   112.17
_cell_angle_beta   108.3
_cell_angle_gamma   90.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YFe2P
_chemical_formula_sum   'Y1 Fe2 P1'
_cell_volume   67.8
_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  0.0  0.0  0.68  1.0
  Fe  Fe1  1  0.7  0.36  0.6  1.0
  Fe  Fe2  1  0.99  0.64  0.88  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Y Fe Fe P