# generated using pymatgen data_Mn(NbTe)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.88034660 _cell_length_b 11.02472530 _cell_length_c 19.21381506 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn(NbTe)4 _chemical_formula_sum 'Mn4 Nb16 Te16' _cell_volume 1033.78933995 _cell_formula_units_Z 4 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 0.24995965 0.50000000 0.50000000 1.0 Mn Mn1 1 0.75004035 0.00000000 0.00000000 1.0 Mn Mn2 1 0.75004035 0.50000000 0.50000000 1.0 Mn Mn3 1 0.24995965 0.00000000 0.00000000 1.0 Nb Nb4 1 0.50000000 0.56365391 0.38327520 1.0 Nb Nb5 1 0.50000000 0.43634609 0.61672480 1.0 Nb Nb6 1 0.50000000 0.06365391 0.11672480 1.0 Nb Nb7 1 0.50000000 0.93634609 0.88327520 1.0 Nb Nb8 1 0.50000000 0.70392494 0.53641876 1.0 Nb Nb9 1 0.50000000 0.29607506 0.46358124 1.0 Nb Nb10 1 0.50000000 0.20392494 0.96358124 1.0 Nb Nb11 1 0.50000000 0.79607506 0.03641876 1.0 Nb Nb12 1 0.00000000 0.68915455 0.44299518 1.0 Nb Nb13 1 0.00000000 0.31084545 0.55700482 1.0 Nb Nb14 1 0.00000000 0.18915455 0.05700482 1.0 Nb Nb15 1 0.00000000 0.81084545 0.94299518 1.0 Nb Nb16 1 0.00000000 0.40098853 0.39171328 1.0 Nb Nb17 1 0.00000000 0.59901147 0.60828672 1.0 Nb Nb18 1 0.00000000 0.90098853 0.10828672 1.0 Nb Nb19 1 0.00000000 0.09901147 0.89171328 1.0 Te Te20 1 0.00000000 0.84434295 0.56160511 1.0 Te Te21 1 0.00000000 0.15565705 0.43839489 1.0 Te Te22 1 0.00000000 0.34434295 0.93839489 1.0 Te Te23 1 0.00000000 0.65565705 0.06160511 1.0 Te Te24 1 0.50000000 0.33287661 0.31709175 1.0 Te Te25 1 0.50000000 0.66712339 0.68290825 1.0 Te Te26 1 0.50000000 0.83287661 0.18290825 1.0 Te Te27 1 0.50000000 0.16712339 0.81709175 1.0 Te Te28 1 0.50000000 0.81992436 0.40395882 1.0 Te Te29 1 0.50000000 0.18007564 0.59604118 1.0 Te Te30 1 0.50000000 0.31992436 0.09604118 1.0 Te Te31 1 0.50000000 0.68007564 0.90395882 1.0 Te Te32 1 0.00000000 0.60719285 0.30253973 1.0 Te Te33 1 0.00000000 0.39280715 0.69746027 1.0 Te Te34 1 0.00000000 0.10719285 0.19746027 1.0 Te Te35 1 0.00000000 0.89280715 0.80253973 1.0