# generated using pymatgen data_Mn3Nb6Al8Zn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.81093009 _cell_length_b 8.86028979 _cell_length_c 8.27152210 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.50795285 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3Nb6Al8Zn _chemical_formula_sum 'Mn6 Nb12 Al16 Zn2' _cell_volume 556.33962147 _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 Mn Mn0 1 0.17084365 0.50245924 0.75000000 1.0 Mn Mn1 1 0.82915635 0.49754076 0.25000000 1.0 Mn Mn2 1 0.49615186 0.66205861 0.75000000 1.0 Mn Mn3 1 0.50115811 0.16583582 0.75000000 1.0 Mn Mn4 1 0.50384814 0.33794139 0.25000000 1.0 Mn Mn5 1 0.49884189 0.83416418 0.25000000 1.0 Nb Nb6 1 0.33540410 0.99917050 0.06381908 1.0 Nb Nb7 1 0.66459590 0.00082950 0.93618092 1.0 Nb Nb8 1 0.99814784 0.33370446 0.06268248 1.0 Nb Nb9 1 0.66459590 0.00082950 0.56381908 1.0 Nb Nb10 1 0.99814784 0.33370446 0.43731752 1.0 Nb Nb11 1 0.00185216 0.66629554 0.93731752 1.0 Nb Nb12 1 0.33540410 0.99917050 0.43618092 1.0 Nb Nb13 1 0.00185216 0.66629554 0.56268248 1.0 Nb Nb14 1 0.66302854 0.66501709 0.06317329 1.0 Nb Nb15 1 0.33697146 0.33498291 0.93682671 1.0 Nb Nb16 1 0.33697146 0.33498291 0.56317329 1.0 Nb Nb17 1 0.66302854 0.66501709 0.43682671 1.0 Al Al18 1 0.34050003 0.84342051 0.75000000 1.0 Al Al19 1 0.65772528 0.50321772 0.75000000 1.0 Al Al20 1 0.65949997 0.15657949 0.25000000 1.0 Al Al21 1 0.34227472 0.49678228 0.25000000 1.0 Al Al22 1 0.84341948 0.34014774 0.75000000 1.0 Al Al23 1 0.15658052 0.65985226 0.25000000 1.0 Al Al24 1 0.33732578 0.66861146 0.50079118 1.0 Al Al25 1 0.66267422 0.33138854 0.49920882 1.0 Al Al26 1 0.66267422 0.33138854 0.00079118 1.0 Al Al27 1 0.33732578 0.66861146 0.99920882 1.0 Al Al28 1 0.17808048 0.00524105 0.75000000 1.0 Al Al29 1 0.82191952 0.99475895 0.25000000 1.0 Al Al30 1 0.00802853 0.18029707 0.75000000 1.0 Al Al31 1 0.99197147 0.81970293 0.25000000 1.0 Al Al32 1 0.82285965 0.82997769 0.75000000 1.0 Al Al33 1 0.17714035 0.17002231 0.25000000 1.0 Zn Zn34 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn35 1 0.00000000 0.00000000 0.00000000 1.0