# generated using pymatgen data_K(Nb3Se4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99770058 _cell_length_b 10.19810227 _cell_length_c 10.77322576 _cell_angle_alpha 118.27988358 _cell_angle_beta 108.98123600 _cell_angle_gamma 89.99842072 _symmetry_Int_Tables_number 1 _chemical_formula_structural K(Nb3Se4)4 _chemical_formula_sum 'K1 Nb12 Se16' _cell_volume 629.18224762 _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 K K0 1 0.50000000 0.00000000 0.00000000 1.0 Nb Nb1 1 0.92854181 0.48835422 0.10565561 1.0 Nb Nb2 1 0.42665413 0.48618927 0.10454995 1.0 Nb Nb3 1 0.12745837 0.61699996 0.51249779 1.0 Nb Nb4 1 0.63636305 0.61791020 0.51351993 1.0 Nb Nb5 1 0.07091762 0.89548918 0.38161771 1.0 Nb Nb6 1 0.56235960 0.89559874 0.38291620 1.0 Nb Nb7 1 0.57334587 0.51381073 0.89545005 1.0 Nb Nb8 1 0.07145819 0.51164578 0.89434439 1.0 Nb Nb9 1 0.36363695 0.38208980 0.48648007 1.0 Nb Nb10 1 0.87254163 0.38300004 0.48750221 1.0 Nb Nb11 1 0.43764040 0.10440126 0.61708380 1.0 Nb Nb12 1 0.92908238 0.10451082 0.61838229 1.0 Se Se13 1 0.51548928 0.34223754 0.28298853 1.0 Se Se14 1 0.01419961 0.34058690 0.27947179 1.0 Se Se15 1 0.70470484 0.93868102 0.65915968 1.0 Se Se16 1 0.20231797 0.94103286 0.65758358 1.0 Se Se17 1 0.40361982 0.71727397 0.06025368 1.0 Se Se18 1 0.90590884 0.71914951 0.05944071 1.0 Se Se19 1 0.98580039 0.65941310 0.72052821 1.0 Se Se20 1 0.48451072 0.65776246 0.71701147 1.0 Se Se21 1 0.79768203 0.05896714 0.34241642 1.0 Se Se22 1 0.29529516 0.06131898 0.34084032 1.0 Se Se23 1 0.09409116 0.28085049 0.94055929 1.0 Se Se24 1 0.59638018 0.28272603 0.93974632 1.0 Se Se25 1 0.70778325 0.33394388 0.66611628 1.0 Se Se26 1 0.20864401 0.33285113 0.66719047 1.0 Se Se27 1 0.79135599 0.66714887 0.33280953 1.0 Se Se28 1 0.29221675 0.66605612 0.33388372 1.0