# generated using pymatgen
data_Ca(CoO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85911148
_cell_length_b   5.64416491
_cell_length_c   8.40897379
_cell_angle_alpha   90.00030023
_cell_angle_beta   89.99997697
_cell_angle_gamma   73.41307668
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(CoO2)3
_chemical_formula_sum   'Ca2 Co6 O12'
_cell_volume   221.02470074
_cell_formula_units_Z   2
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  0.00000100  0.50000000  0.16682440  1.0
  Ca  Ca1  1  0.49999900  0.50000000  0.66669752  1.0
  Co  Co2  1  0.50000000  1.00000000  0.16665129  1.0
  Co  Co3  1  0.50000000  0.99999900  0.83459450  1.0
  Co  Co4  1  0.50000000  0.00000000  0.49872105  1.0
  Co  Co5  1  1.00000000  0.00000000  0.66665306  1.0
  Co  Co6  1  0.00000000  1.00000000  0.33458869  1.0
  Co  Co7  1  0.00000000  1.00000000  0.99873250  1.0
  O  O8  1  0.77641396  0.17834960  0.16667074  1.0
  O  O9  1  0.27640917  0.17836500  0.66665294  1.0
  O  O10  1  0.22358604  0.82165140  0.16666974  1.0
  O  O11  1  0.72359083  0.82163400  0.66665194  1.0
  O  O12  1  0.27216360  0.18074180  0.00111942  1.0
  O  O13  1  0.77216917  0.18076486  0.50107293  1.0
  O  O14  1  0.27214846  0.18073201  0.33221000  1.0
  O  O15  1  0.77216342  0.18072717  0.83221398  1.0
  O  O16  1  0.72785154  0.81926799  0.33220800  1.0
  O  O17  1  0.22783558  0.81927283  0.83221298  1.0
  O  O18  1  0.72783740  0.81925820  0.00111843  1.0
  O  O19  1  0.22783083  0.81923414  0.50107093  1.0