# generated using pymatgen data_Ca2Co9O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.23532238 _cell_length_b 5.23532238 _cell_length_c 16.61302982 _cell_angle_alpha 81.31589150 _cell_angle_beta 81.31589150 _cell_angle_gamma 33.88239266 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Co9O13 _chemical_formula_sum 'Ca2 Co9 O13' _cell_volume 250.66555219 _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 0.78289900 0.78289900 0.22784600 1.0 Ca Ca1 1 0.21710100 0.21710100 0.77215400 1.0 Co Co2 1 0.50000000 0.50000000 0.50000000 1.0 Co Co3 1 0.35487400 0.35487400 0.03788800 1.0 Co Co4 1 0.64512600 0.64512600 0.96211200 1.0 Co Co5 1 0.24557600 0.24557600 0.42100400 1.0 Co Co6 1 0.75442400 0.75442400 0.57899600 1.0 Co Co7 1 0.06226800 0.06226800 0.12425400 1.0 Co Co8 1 0.93773200 0.93773200 0.87574600 1.0 Co Co9 1 0.99896000 0.99896000 0.33898900 1.0 Co Co10 1 0.00104000 0.00104000 0.66101100 1.0 O O11 1 0.00000000 0.00000000 0.00000000 1.0 O O12 1 0.10821600 0.10821600 0.22501300 1.0 O O13 1 0.89178400 0.89178400 0.77498700 1.0 O O14 1 0.70198800 0.70198800 0.07534300 1.0 O O15 1 0.29801200 0.29801200 0.92465700 1.0 O O16 1 0.42496200 0.42496200 0.14214900 1.0 O O17 1 0.57503800 0.57503800 0.85785100 1.0 O O18 1 0.36644300 0.36644300 0.31904200 1.0 O O19 1 0.63355700 0.63355700 0.68095800 1.0 O O20 1 0.61632800 0.61632800 0.38701900 1.0 O O21 1 0.38367200 0.38367200 0.61298100 1.0 O O22 1 0.86934200 0.86934200 0.46584000 1.0 O O23 1 0.13065800 0.13065800 0.53416000 1.0