# generated using pymatgen data_Mn2SiMo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.66783984 _cell_length_b 4.66783984 _cell_length_c 7.77080007 _cell_angle_alpha 87.86022688 _cell_angle_beta 87.86022688 _cell_angle_gamma 61.26087889 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2SiMo _chemical_formula_sum 'Mn6 Si3 Mo3' _cell_volume 148.31937174 _cell_formula_units_Z 3 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 Mn Mn0 1 0.98919700 0.98919700 0.49477700 1.0 Mn Mn1 1 0.00928800 0.00928800 0.00825900 1.0 Mn Mn2 1 0.81728000 0.81728000 0.25041600 1.0 Mn Mn3 1 0.81261800 0.33416500 0.25658700 1.0 Mn Mn4 1 0.33416500 0.81261800 0.25658700 1.0 Mn Mn5 1 0.18253200 0.18253200 0.72962200 1.0 Si Si6 1 0.17820400 0.67425900 0.76450500 1.0 Si Si7 1 0.67425900 0.17820400 0.76450500 1.0 Si Si8 1 0.31497900 0.31497900 0.40813600 1.0 Mo Mo9 1 0.68672300 0.68672300 0.56581300 1.0 Mo Mo10 1 0.67273000 0.67273000 0.93823800 1.0 Mo Mo11 1 0.32829800 0.32829800 0.06262900 1.0