# generated using pymatgen data_Be4Mo6Ir2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.67259788 _cell_length_b 7.67259752 _cell_length_c 7.67259647 _cell_angle_alpha 59.99999174 _cell_angle_beta 59.99999329 _cell_angle_gamma 59.99999643 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be4Mo6Ir2C _chemical_formula_sum 'Be8 Mo12 Ir4 C2' _cell_volume 319.38326277 _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 Be Be0 1 0.33197053 0.33197053 0.00408641 1.0 Be Be1 1 0.33197053 0.33197053 0.33197053 1.0 Be Be2 1 0.24591359 0.91802947 0.91802947 1.0 Be Be3 1 0.91802947 0.91802947 0.91802947 1.0 Be Be4 1 0.00408641 0.33197053 0.33197053 1.0 Be Be5 1 0.33197053 0.00408641 0.33197053 1.0 Be Be6 1 0.91802947 0.91802947 0.24591359 1.0 Be Be7 1 0.91802947 0.24591359 0.91802947 1.0 Mo Mo8 1 0.30382926 0.69617074 0.69617074 1.0 Mo Mo9 1 0.69617074 0.69617074 0.30382926 1.0 Mo Mo10 1 0.69617074 0.30382926 0.69617074 1.0 Mo Mo11 1 0.30382926 0.69617074 0.30382926 1.0 Mo Mo12 1 0.55382926 0.94617074 0.55382926 1.0 Mo Mo13 1 0.55382926 0.94617074 0.94617074 1.0 Mo Mo14 1 0.94617074 0.55382926 0.55382926 1.0 Mo Mo15 1 0.94617074 0.55382926 0.94617074 1.0 Mo Mo16 1 0.30382926 0.30382926 0.69617074 1.0 Mo Mo17 1 0.55382926 0.55382926 0.94617074 1.0 Mo Mo18 1 0.94617074 0.94617074 0.55382926 1.0 Mo Mo19 1 0.69617074 0.30382926 0.30382926 1.0 Ir Ir20 1 0.12500000 0.62500000 0.12500000 1.0 Ir Ir21 1 0.12500000 0.12500000 0.62500000 1.0 Ir Ir22 1 0.62500000 0.12500000 0.12500000 1.0 Ir Ir23 1 0.12500000 0.12500000 0.12500000 1.0 C C24 1 0.50000000 0.50000000 0.50000000 1.0 C C25 1 0.75000000 0.75000000 0.75000000 1.0