# generated using pymatgen
data_Ca(CuP)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00649082
_cell_length_b   4.00649162
_cell_length_c   5.60514657
_cell_angle_alpha   110.94023039
_cell_angle_beta   110.94024706
_cell_angle_gamma   89.99998920
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(CuP)2
_chemical_formula_sum   'Ca1 Cu2 P2'
_cell_volume   77.63527932
_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
  Cu  Cu1  1  0.25000000  0.75000000  0.50000000  1.0
  Cu  Cu2  1  0.75000000  0.25000000  0.50000000  1.0
  P  P3  1  0.61877935  0.61877935  0.23755770  1.0
  P  P4  1  0.38122065  0.38122065  0.76244230  1.0