# generated using pymatgen data_Si3Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06771000 _cell_length_b 7.31965373 _cell_length_c 7.31997345 _cell_angle_alpha 119.99855920 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Si3Mo5 _chemical_formula_sum 'Si6 Mo10' _cell_volume 235.15203061 _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 Si Si0 1 0.74998000 0.60722100 0.00000000 1.0 Si Si1 1 0.75001000 0.39279400 0.39287100 1.0 Si Si2 1 0.75001000 0.99992300 0.60712900 1.0 Si Si3 1 0.24998000 0.39277900 0.00000000 1.0 Si Si4 1 0.25001000 0.60720600 0.60712900 1.0 Si Si5 1 0.25001000 0.00007700 0.39287100 1.0 Mo Mo6 1 0.50000000 0.33333400 0.66668800 1.0 Mo Mo7 1 0.50000000 0.66664700 0.33331200 1.0 Mo Mo8 1 0.00000000 0.66666600 0.33331200 1.0 Mo Mo9 1 0.00000000 0.33335300 0.66668800 1.0 Mo Mo10 1 0.75000400 0.23988900 0.00000000 1.0 Mo Mo11 1 0.74999800 0.76014400 0.76009800 1.0 Mo Mo12 1 0.74999800 0.00004600 0.23990200 1.0 Mo Mo13 1 0.25000400 0.76011100 0.00000000 1.0 Mo Mo14 1 0.24999800 0.23985600 0.23990200 1.0 Mo Mo15 1 0.24999800 0.99995400 0.76009800 1.0