# generated using pymatgen data_Ba2IrC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.11094712 _cell_length_b 5.11094716 _cell_length_c 5.30634477 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000610 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2IrC2 _chemical_formula_sum 'Ba2 Ir1 C2' _cell_volume 120.04079076 _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 Ba Ba0 1 0.33333300 0.66666700 0.26947660 1.0 Ba Ba1 1 0.66666700 0.33333300 0.73052340 1.0 Ir Ir2 1 0.00000000 0.00000000 0.00000000 1.0 C C3 1 0.00000000 0.00000000 0.37718471 1.0 C C4 1 0.00000000 0.00000000 0.62281529 1.0