# generated using pymatgen data_Nb3V2Ge3H _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52291120 _cell_length_b 7.52291188 _cell_length_c 5.08365678 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000137 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3V2Ge3H _chemical_formula_sum 'Nb6 V4 Ge6 H2' _cell_volume 249.16024948 _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 Nb Nb0 1 0.76091632 0.76091632 0.75000000 1.0 Nb Nb1 1 0.23908368 0.00000000 0.75000000 1.0 Nb Nb2 1 1.00000000 0.23908368 0.75000000 1.0 Nb Nb3 1 0.23908368 0.23908368 0.25000000 1.0 Nb Nb4 1 0.76091632 1.00000000 0.25000000 1.0 Nb Nb5 1 0.00000000 0.76091632 0.25000000 1.0 V V6 1 0.66666700 0.33333300 0.00000000 1.0 V V7 1 0.33333300 0.66666700 0.00000000 1.0 V V8 1 0.33333300 0.66666700 0.50000000 1.0 V V9 1 0.66666700 0.33333300 0.50000000 1.0 Ge Ge10 1 0.40412763 0.40412763 0.75000000 1.0 Ge Ge11 1 0.59587237 1.00000000 0.75000000 1.0 Ge Ge12 1 0.00000000 0.59587237 0.75000000 1.0 Ge Ge13 1 0.59587237 0.59587237 0.25000000 1.0 Ge Ge14 1 0.40412763 0.00000000 0.25000000 1.0 Ge Ge15 1 1.00000000 0.40412763 0.25000000 1.0 H H16 1 0.00000000 0.00000000 0.00000000 1.0 H H17 1 0.00000000 0.00000000 0.50000000 1.0