# generated using pymatgen data_Be4Ni2Mo6C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.50279557 _cell_length_b 7.50279571 _cell_length_c 7.50279472 _cell_angle_alpha 59.99999567 _cell_angle_beta 59.99999502 _cell_angle_gamma 59.99999984 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be4Ni2Mo6C _chemical_formula_sum 'Be8 Ni4 Mo12 C2' _cell_volume 298.64432732 _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 0.32700504 0.32700504 0.01898387 1.0 Be Be1 1 0.32700504 0.32700504 0.32700504 1.0 Be Be2 1 0.23101613 0.92299496 0.92299496 1.0 Be Be3 1 0.92299496 0.92299496 0.92299496 1.0 Be Be4 1 0.01898387 0.32700504 0.32700504 1.0 Be Be5 1 0.32700504 0.01898387 0.32700504 1.0 Be Be6 1 0.92299496 0.92299496 0.23101613 1.0 Be Be7 1 0.92299496 0.23101613 0.92299496 1.0 Ni Ni8 1 0.12500000 0.62500000 0.12500000 1.0 Ni Ni9 1 0.12500000 0.12500000 0.62500000 1.0 Ni Ni10 1 0.62500000 0.12500000 0.12500000 1.0 Ni Ni11 1 0.12500000 0.12500000 0.12500000 1.0 Mo Mo12 1 0.29986892 0.70013108 0.70013108 1.0 Mo Mo13 1 0.70013108 0.70013108 0.29986892 1.0 Mo Mo14 1 0.70013108 0.29986892 0.70013108 1.0 Mo Mo15 1 0.29986892 0.70013108 0.29986892 1.0 Mo Mo16 1 0.54986892 0.95013108 0.54986892 1.0 Mo Mo17 1 0.54986892 0.95013108 0.95013108 1.0 Mo Mo18 1 0.95013108 0.54986892 0.54986892 1.0 Mo Mo19 1 0.95013108 0.54986892 0.95013108 1.0 Mo Mo20 1 0.29986892 0.29986892 0.70013108 1.0 Mo Mo21 1 0.54986892 0.54986892 0.95013108 1.0 Mo Mo22 1 0.95013108 0.95013108 0.54986892 1.0 Mo Mo23 1 0.70013108 0.29986892 0.29986892 1.0 C C24 1 0.50000000 0.50000000 0.50000000 1.0 C C25 1 0.75000000 0.75000000 0.75000000 1.0