# generated using pymatgen
data_Ca(FeP)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.79624928
_cell_length_b   3.79624871
_cell_length_c   5.66530476
_cell_angle_alpha   109.57519121
_cell_angle_beta   109.57518006
_cell_angle_gamma   90.00001121
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(FeP)2
_chemical_formula_sum   'Ca1 Fe2 P2'
_cell_volume   71.89872824
_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
  Fe  Fe1  1  0.75000000  0.25000000  0.50000000  1.0
  Fe  Fe2  1  0.25000000  0.75000000  0.50000000  1.0
  P  P3  1  0.64358544  0.64358544  0.28716888  1.0
  P  P4  1  0.35641456  0.35641456  0.71283112  1.0