# generated using pymatgen
data_Ca4P2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49845931
_cell_length_b   4.49846054
_cell_length_c   8.16946033
_cell_angle_alpha   105.98119184
_cell_angle_beta   105.98119061
_cell_angle_gamma   89.99999326
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4P2O
_chemical_formula_sum   'Ca4 P2 O1'
_cell_volume   152.27210378
_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  0.82674203  0.82674203  0.65348507  1.0
  Ca  Ca1  1  0.17325797  0.17325797  0.34651493  1.0
  Ca  Ca2  1  -0.00000000  0.50000000  -0.00000000  1.0
  Ca  Ca3  1  0.50000000  -0.00000000  -0.00000000  1.0
  P  P4  1  0.63597249  0.63597249  0.27194598  1.0
  P  P5  1  0.36402751  0.36402751  0.72805402  1.0
  O  O6  1  -0.00000000  -0.00000000  -0.00000000  1.0