# generated using pymatgen data_Mg6Si7Ni16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.91830736 _cell_length_b 7.91829144 _cell_length_c 7.91830218 _cell_angle_alpha 60.00141619 _cell_angle_beta 60.00148490 _cell_angle_gamma 60.00144050 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6Si7Ni16 _chemical_formula_sum 'Mg6 Si7 Ni16' _cell_volume 351.07116519 _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 0.20426293 0.20426137 0.79573215 1.0 Mg Mg1 1 0.20426236 0.79573372 0.20426235 1.0 Mg Mg2 1 0.20426638 0.79573965 0.79573631 1.0 Mg Mg3 1 0.79573761 0.20426558 0.79573834 1.0 Mg Mg4 1 0.79573166 0.20426149 0.20426254 1.0 Mg Mg5 1 0.79573625 0.79573999 0.20426643 1.0 Si Si6 1 0.49999950 0.49999921 -0.00000002 1.0 Si Si7 1 0.00000408 0.00000458 0.49999910 1.0 Si Si8 1 0.49999930 0.50000058 0.49999888 1.0 Si Si9 1 0.00000199 0.49999762 -0.00000039 1.0 Si Si10 1 0.49999781 0.00000269 -0.00000010 1.0 Si Si11 1 0.49999175 0.00000415 0.50000061 1.0 Si Si12 1 0.00000337 0.49999174 0.50000093 1.0 Ni Ni13 1 0.16839200 0.49483491 0.16838887 1.0 Ni Ni14 1 0.38197880 0.85407547 0.38197690 1.0 Ni Ni15 1 0.61801431 0.61802229 0.61801596 1.0 Ni Ni16 1 0.16839249 0.16838320 0.49484054 1.0 Ni Ni17 1 0.61801457 0.14594707 0.61801533 1.0 Ni Ni18 1 0.61801112 0.61801890 0.14594944 1.0 Ni Ni19 1 0.83161930 0.50513429 0.83162021 1.0 Ni Ni20 1 0.14594886 0.61801908 0.61801222 1.0 Ni Ni21 1 0.38197738 0.38196953 0.38197556 1.0 Ni Ni22 1 0.16839148 0.16838256 0.16838882 1.0 Ni Ni23 1 0.83161980 0.83162729 0.83162009 1.0 Ni Ni24 1 0.83161720 0.83162526 0.50513402 1.0 Ni Ni25 1 0.38198288 0.38197327 0.85407230 1.0 Ni Ni26 1 0.50513306 0.83162561 0.83161823 1.0 Ni Ni27 1 0.85407091 0.38197506 0.38198146 1.0 Ni Ni28 1 0.49483886 0.16838486 0.16839091 1.0