# generated using pymatgen data_Tc5MoSe8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.69665150 _cell_length_b 6.68147171 _cell_length_c 6.70613882 _cell_angle_alpha 93.24142793 _cell_angle_beta 93.15556307 _cell_angle_gamma 93.82757953 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tc5MoSe8 _chemical_formula_sum 'Tc5 Mo1 Se8' _cell_volume 298.38622865 _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 Tc Tc0 1 0.45195266 0.58620652 0.76229709 1.0 Tc Tc1 1 0.76166676 0.45236837 0.58603070 1.0 Tc Tc2 1 0.58644776 0.76064209 0.45268664 1.0 Tc Tc3 1 0.54802625 0.41392333 0.23923226 1.0 Tc Tc4 1 0.23837287 0.54723029 0.41364603 1.0 Mo Mo5 1 0.41246300 0.23810394 0.54762588 1.0 Se Se6 1 0.78241059 0.78235712 0.78066958 1.0 Se Se7 1 0.21557846 0.21831206 0.21447074 1.0 Se Se8 1 0.27311149 0.87104086 0.62490582 1.0 Se Se9 1 0.62462873 0.27424747 0.87693991 1.0 Se Se10 1 0.87458601 0.62561331 0.27242261 1.0 Se Se11 1 0.73106854 0.12611824 0.37343801 1.0 Se Se12 1 0.37690490 0.72709403 0.12630987 1.0 Se Se13 1 0.12278198 0.37674236 0.72932785 1.0