# generated using pymatgen data_Mg5Co16(TcP4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.75669751 _cell_length_b 11.75669843 _cell_length_c 3.58587571 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999740 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Co16(TcP4)3 _chemical_formula_sum 'Mg5 Co16 Tc3 P12' _cell_volume 429.23645387 _cell_formula_units_Z 1 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 Mg Mg0 1 0.66666700 0.33333300 0.00000000 1.0 Mg Mg1 1 0.33333300 0.66666700 0.00000000 1.0 Mg Mg2 1 0.81991683 0.81991683 0.50000000 1.0 Mg Mg3 1 0.18008317 0.00000000 0.50000000 1.0 Mg Mg4 1 1.00000000 0.18008317 0.50000000 1.0 Co Co5 1 0.19677973 0.37462078 0.00000000 1.0 Co Co6 1 0.17784205 0.80322027 0.00000000 1.0 Co Co7 1 0.82215795 0.62537922 0.00000000 1.0 Co Co8 1 0.80322027 0.17784205 0.00000000 1.0 Co Co9 1 0.37462078 0.19677973 0.00000000 1.0 Co Co10 1 0.13007824 0.48115007 0.50000000 1.0 Co Co11 1 0.35107083 0.86992176 0.50000000 1.0 Co Co12 1 0.51884993 0.64892917 0.50000000 1.0 Co Co13 1 0.64892917 0.51884993 0.50000000 1.0 Co Co14 1 0.86992176 0.35107083 0.50000000 1.0 Co Co15 1 0.48115007 0.13007824 0.50000000 1.0 Co Co16 1 0.00000000 0.00000000 0.00000000 1.0 Co Co17 1 0.71886957 0.00000000 0.50000000 1.0 Co Co18 1 0.00000000 0.71886957 0.50000000 1.0 Co Co19 1 0.62537922 0.82215795 0.00000000 1.0 Co Co20 1 0.28113043 0.28113043 0.50000000 1.0 Tc Tc21 1 0.44933145 0.44933145 0.00000000 1.0 Tc Tc22 1 0.55066855 0.00000000 0.00000000 1.0 Tc Tc23 1 1.00000000 0.55066855 0.00000000 1.0 P P24 1 0.64374391 0.64374391 0.00000000 1.0 P P25 1 0.35625609 0.00000000 0.00000000 1.0 P P26 1 1.00000000 0.35625609 0.00000000 1.0 P P27 1 0.48420291 0.31850900 0.50000000 1.0 P P28 1 0.68149100 0.16569491 0.50000000 1.0 P P29 1 0.83430509 0.51579709 0.50000000 1.0 P P30 1 0.51579709 0.83430509 0.50000000 1.0 P P31 1 0.16569491 0.68149100 0.50000000 1.0 P P32 1 0.82344627 0.00000000 0.00000000 1.0 P P33 1 0.00000000 0.82344627 0.00000000 1.0 P P34 1 0.31850900 0.48420291 0.50000000 1.0 P P35 1 0.17655373 0.17655373 0.00000000 1.0