# generated using pymatgen data_CaCoSi2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.94430040 _cell_length_b 7.94430040 _cell_length_c 5.19353900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.27928497 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaCoSi2O7 _chemical_formula_sum 'Ca2 Co2 Si4 O14' _cell_volume 327.77026590 _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 0.83927500 0.16072500 0.52229800 1.0 Ca Ca1 1 0.16072500 0.83927500 0.52229800 1.0 Co Co2 1 0.50000000 0.00000000 0.99452600 1.0 Co Co3 1 0.00000000 0.50000000 0.99452600 1.0 Si Si4 1 0.13610400 0.13610400 0.05143400 1.0 Si Si5 1 0.35792000 0.64208000 0.94815800 1.0 Si Si6 1 0.64208000 0.35792000 0.94815800 1.0 Si Si7 1 0.86389600 0.86389600 0.05143400 1.0 O O8 1 0.31733500 0.07912900 0.17129800 1.0 O O9 1 0.68266500 0.92087100 0.17129800 1.0 O O10 1 0.59117300 0.17794000 0.80471900 1.0 O O11 1 0.40882700 0.82206000 0.80471900 1.0 O O12 1 0.07912900 0.31733500 0.17129800 1.0 O O13 1 0.17794000 0.59117300 0.80471900 1.0 O O14 1 0.82206000 0.40882700 0.80471900 1.0 O O15 1 0.92087100 0.68266500 0.17129800 1.0 O O16 1 0.11400900 0.11400900 0.74157800 1.0 O O17 1 0.31791200 0.68208800 0.24572900 1.0 O O18 1 0.50000000 0.50000000 0.89427300 1.0 O O19 1 0.00000000 0.00000000 0.19536800 1.0 O O20 1 0.68208800 0.31791200 0.24572900 1.0 O O21 1 0.88599100 0.88599100 0.74157800 1.0