data_YTeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   4.8
_cell_length_c   3.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   98.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTeP2
_chemical_formula_sum   'Y1 Te1 P2'
_cell_volume   84.06
_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  0.0  0.0  0.0  1.0
  Te  Te2  1  0.13  0.0  0.0  1.0
  P  P0  1  0.56  0.82  0.84  1.0
  P  P1  1  0.56  0.18  0.84  1.0

data_YTeP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.69
_cell_length_b   4.8
_cell_length_c   4.8
_cell_angle_alpha   98.72
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTeP2
_chemical_formula_sum   'Y1 Te1 P2'
_cell_volume   84.06
_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  0.0  1.0
  Te  Te1  1  0.0  0.13  0.0  1.0
  P  P2  1  0.84  0.56  0.18  1.0
  P  P3  1  0.84  0.56  0.82  1.0

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