# generated using pymatgen data_Si3Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.89711669 _cell_length_b 7.24696983 _cell_length_c 7.24697039 _cell_angle_alpha 83.44490674 _cell_angle_beta 70.25263081 _cell_angle_gamma 70.25263555 _symmetry_Int_Tables_number 1 _chemical_formula_structural Si3Mo5 _chemical_formula_sum 'Si6 Mo10' _cell_volume 227.82922166 _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 0.83278363 0.50000000 0.83443375 1.0 Si Si1 1 0.66721637 0.16556625 0.50000000 1.0 Si Si2 1 0.33278363 0.83443375 0.50000000 1.0 Si Si3 1 0.16721637 0.50000000 0.16556625 1.0 Si Si4 1 0.75000000 0.00000000 -0.00000000 1.0 Si Si5 1 0.25000000 0.00000000 -0.00000000 1.0 Mo Mo6 1 0.27611901 0.14694172 0.30081926 1.0 Mo Mo7 1 0.72388099 0.85305828 0.69918074 1.0 Mo Mo8 1 0.42305973 0.30081926 0.85305828 1.0 Mo Mo9 1 0.57694027 0.69918074 0.14694172 1.0 Mo Mo10 1 0.92305973 0.85305828 0.30081926 1.0 Mo Mo11 1 0.22388099 0.69918074 0.85305828 1.0 Mo Mo12 1 0.77611901 0.30081926 0.14694172 1.0 Mo Mo13 1 0.07694027 0.14694172 0.69918074 1.0 Mo Mo14 1 0.75000000 0.50000000 0.50000000 1.0 Mo Mo15 1 0.25000000 0.50000000 0.50000000 1.0