data_SrP2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77
_cell_length_b   5.77
_cell_length_c   5.77
_cell_angle_alpha   140.08
_cell_angle_beta   140.08
_cell_angle_gamma   57.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrP2W
_chemical_formula_sum   'Sr1 P2 W1'
_cell_volume   78.54
_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
  Sr  Sr2  1  0.0  0.0  0.06  1.0
  P  P0  1  0.0  0.0  0.0  1.0
  P  P1  1  0.97  0.0  0.53  1.0
  W  W3  1  0.0  0.97  0.53  1.0

data_SrP2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.94
_cell_length_b   3.94
_cell_length_c   5.77
_cell_angle_alpha   109.96
_cell_angle_beta   109.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrP2W
_chemical_formula_sum   'Sr1 P2 W1'
_cell_volume   78.54
_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
  Sr  Sr0  1  0.06  0.06  0.06  1.0
  P  P1  1  0.0  0.0  0.0  1.0
  P  P2  1  0.53  0.56  0.56  1.0
  W  W3  1  0.56  0.53  0.56  1.0

Sr P P W
Sr P P W 0 1 o o o 2 3 + - o 