# generated using pymatgen data_PaCoC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.53598428 _cell_length_b 3.53598428 _cell_length_c 7.30226990 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaCoC2 _chemical_formula_sum 'Pa2 Co2 C4' _cell_volume 91.30163024 _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 Pa Pa0 1 0.00000000 0.50000000 0.31449136 1.0 Pa Pa1 1 0.50000000 0.00000000 0.68550864 1.0 Co Co2 1 0.50000000 0.50000000 0.00000000 1.0 Co Co3 1 0.00000000 0.00000000 0.00000000 1.0 C C4 1 0.00000000 0.50000000 0.84585530 1.0 C C5 1 0.50000000 0.00000000 0.15414470 1.0 C C6 1 0.00000000 0.50000000 0.64351511 1.0 C C7 1 0.50000000 0.00000000 0.35648489 1.0