# generated using pymatgen
data_Ca(PRu)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.04659572
_cell_length_b   4.04659502
_cell_length_c   5.72935379
_cell_angle_alpha   110.67985185
_cell_angle_beta   110.67985787
_cell_angle_gamma   90.00000401
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(PRu)2
_chemical_formula_sum   'Ca1 P2 Ru2'
_cell_volume   81.27977811
_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
  Ca  Ca0  1  -0.00000000  -0.00000000  0.00000000  1.0
  P  P1  1  0.63571089  0.63571089  0.27142279  1.0
  P  P2  1  0.36428911  0.36428911  0.72857721  1.0
  Ru  Ru3  1  0.25000000  0.75000000  0.50000000  1.0
  Ru  Ru4  1  0.75000000  0.25000000  0.50000000  1.0