# generated using pymatgen data_K2Ca(CO3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73169622 _cell_length_b 6.73169622 _cell_length_c 6.73169630 _cell_angle_alpha 47.20949245 _cell_angle_beta 47.20949245 _cell_angle_gamma 47.20949120 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2Ca(CO3)2 _chemical_formula_sum 'K2 Ca1 C2 O6' _cell_volume 150.23687544 _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 K K0 1 0.20918015 0.20918015 0.20918015 1.0 K K1 1 0.79081985 0.79081985 0.79081985 1.0 Ca Ca2 1 -0.00000000 0.00000000 -0.00000000 1.0 C C3 1 0.58737900 0.58737900 0.58737900 1.0 C C4 1 0.41262100 0.41262100 0.41262100 1.0 O O5 1 0.27462029 0.68987006 0.27462029 1.0 O O6 1 0.27462029 0.27462029 0.68987006 1.0 O O7 1 0.68987006 0.27462029 0.27462029 1.0 O O8 1 0.31012994 0.72537971 0.72537971 1.0 O O9 1 0.72537971 0.72537971 0.31012994 1.0 O O10 1 0.72537971 0.31012994 0.72537971 1.0