data_KY2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.64
_cell_length_b   9.64
_cell_length_c   9.64
_cell_angle_alpha   157.61
_cell_angle_beta   155.84
_cell_angle_gamma   33.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KY2P
_chemical_formula_sum   'K1 Y2 P1'
_cell_volume   139.74
_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
  K  K0  1  0.0  0.02  0.33  1.0
  Y  Y2  1  0.0  0.02  0.37  1.0
  Y  Y3  1  0.0  0.0  0.67  1.0
  P  P1  1  0.0  0.0  0.36  1.0

data_KY2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.75
_cell_length_b   4.04
_cell_length_c   9.64
_cell_angle_alpha   102.08
_cell_angle_beta   101.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KY2P
_chemical_formula_sum   'K1 Y2 P1'
_cell_volume   139.74
_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
  K  K0  1  0.67  0.69  0.69  1.0
  Y  Y1  1  0.33  0.33  0.33  1.0
  Y  Y2  1  0.63  0.65  0.65  1.0
  P  P3  1  0.64  0.64  0.64  1.0

K Y Y P
K Y Y P 0 3 o o o 0 1 o o o 0 2 o o o 1 3 o o o 1 2 o o o 2 3 o o o 