# generated using pymatgen data_Mn5Si2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73965600 _cell_length_b 8.73965600 _cell_length_c 8.55122800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn5Si2 _chemical_formula_sum 'Mn40 Si16' _cell_volume 653.15636542 _cell_formula_units_Z 8 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 0.31357300 0.92020200 0.41899800 1.0 Mn Mn1 1 0.68642700 0.07979800 0.91899800 1.0 Mn Mn2 1 0.57979800 0.81357300 0.16899800 1.0 Mn Mn3 1 0.42020200 0.18642700 0.66899800 1.0 Mn Mn4 1 0.07979800 0.68642700 0.08100200 1.0 Mn Mn5 1 0.92020200 0.31357300 0.58100200 1.0 Mn Mn6 1 0.81357300 0.57979800 0.83100200 1.0 Mn Mn7 1 0.18642700 0.42020200 0.33100200 1.0 Mn Mn8 1 0.27626000 0.67360900 0.59740200 1.0 Mn Mn9 1 0.72374000 0.32639100 0.09740200 1.0 Mn Mn10 1 0.82639100 0.77626000 0.34740200 1.0 Mn Mn11 1 0.17360900 0.22374000 0.84740200 1.0 Mn Mn12 1 0.32639100 0.72374000 0.90259800 1.0 Mn Mn13 1 0.67360900 0.27626000 0.40259800 1.0 Mn Mn14 1 0.77626000 0.82639100 0.65259800 1.0 Mn Mn15 1 0.22374000 0.17360900 0.15259800 1.0 Mn Mn16 1 0.36347500 0.63652500 0.25000000 1.0 Mn Mn17 1 0.63652500 0.36347500 0.75000000 1.0 Mn Mn18 1 0.86347500 0.86347500 0.00000000 1.0 Mn Mn19 1 0.13652500 0.13652500 0.50000000 1.0 Mn Mn20 1 0.04618100 0.95381900 0.25000000 1.0 Mn Mn21 1 0.95381900 0.04618100 0.75000000 1.0 Mn Mn22 1 0.54618100 0.54618100 0.00000000 1.0 Mn Mn23 1 0.45381900 0.45381900 0.50000000 1.0 Mn Mn24 1 0.04325000 0.86925600 0.53602200 1.0 Mn Mn25 1 0.95675000 0.13074400 0.03602200 1.0 Mn Mn26 1 0.63074400 0.54325000 0.28602200 1.0 Mn Mn27 1 0.36925600 0.45675000 0.78602200 1.0 Mn Mn28 1 0.13074400 0.95675000 0.96397800 1.0 Mn Mn29 1 0.86925600 0.04325000 0.46397800 1.0 Mn Mn30 1 0.54325000 0.63074400 0.71397800 1.0 Mn Mn31 1 0.45675000 0.36925600 0.21397800 1.0 Mn Mn32 1 0.49083400 0.89800900 0.67575500 1.0 Mn Mn33 1 0.50916600 0.10199100 0.17575500 1.0 Mn Mn34 1 0.60199100 0.99083400 0.42575500 1.0 Mn Mn35 1 0.39800900 0.00916600 0.92575500 1.0 Mn Mn36 1 0.10199100 0.50916600 0.82424500 1.0 Mn Mn37 1 0.89800900 0.49083400 0.32424500 1.0 Mn Mn38 1 0.99083400 0.60199100 0.57424500 1.0 Mn Mn39 1 0.00916600 0.39800900 0.07424500 1.0 Si Si40 1 0.23499400 0.96749400 0.70156500 1.0 Si Si41 1 0.76500600 0.03250600 0.20156500 1.0 Si Si42 1 0.53250600 0.73499400 0.45156500 1.0 Si Si43 1 0.46749400 0.26500600 0.95156500 1.0 Si Si44 1 0.03250600 0.76500600 0.79843500 1.0 Si Si45 1 0.96749400 0.23499400 0.29843500 1.0 Si Si46 1 0.73499400 0.53250600 0.54843500 1.0 Si Si47 1 0.26500600 0.46749400 0.04843500 1.0 Si Si48 1 0.30760600 0.88415500 0.14842100 1.0 Si Si49 1 0.69239400 0.11584500 0.64842100 1.0 Si Si50 1 0.61584500 0.80760600 0.89842100 1.0 Si Si51 1 0.38415500 0.19239400 0.39842100 1.0 Si Si52 1 0.11584500 0.69239400 0.35157900 1.0 Si Si53 1 0.88415500 0.30760600 0.85157900 1.0 Si Si54 1 0.80760600 0.61584500 0.10157900 1.0 Si Si55 1 0.19239400 0.38415500 0.60157900 1.0