# generated using pymatgen data_Nb6V4Ge6B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.56817052 _cell_length_b 7.56817061 _cell_length_c 5.09703687 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000394 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb6V4Ge6B _chemical_formula_sum 'Nb6 V4 Ge6 B1' _cell_volume 252.83093564 _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 Nb Nb0 1 1.00000000 0.75632568 0.24599813 1.0 Nb Nb1 1 0.24367432 0.24367432 0.24599813 1.0 Nb Nb2 1 0.75632568 1.00000000 0.24599813 1.0 Nb Nb3 1 0.00000000 0.24367432 0.75400187 1.0 Nb Nb4 1 0.75632568 0.75632568 0.75400187 1.0 Nb Nb5 1 0.24367432 0.00000000 0.75400187 1.0 V V6 1 0.33333300 0.66666700 0.50000000 1.0 V V7 1 0.66666700 0.33333300 0.50000000 1.0 V V8 1 0.66666700 0.33333300 0.00000000 1.0 V V9 1 0.33333300 0.66666700 0.00000000 1.0 Ge Ge10 1 0.00000000 0.40284782 0.24843998 1.0 Ge Ge11 1 0.59715218 0.59715218 0.24843998 1.0 Ge Ge12 1 0.40284782 0.00000000 0.24843998 1.0 Ge Ge13 1 1.00000000 0.59715218 0.75156002 1.0 Ge Ge14 1 0.40284782 0.40284782 0.75156002 1.0 Ge Ge15 1 0.59715218 1.00000000 0.75156002 1.0 B B16 1 0.00000000 0.00000000 0.50000000 1.0