# generated using pymatgen data_Zr4PaV6Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.35954093 _cell_length_b 5.35954151 _cell_length_c 8.42380226 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000251 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4PaV6Mo _chemical_formula_sum 'Zr4 Pa1 V6 Mo1' _cell_volume 209.55306405 _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 Zr Zr0 1 0.33333300 0.66666700 0.43295811 1.0 Zr Zr1 1 0.66666700 0.33333300 0.56704189 1.0 Zr Zr2 1 0.66666700 0.33333300 0.93977048 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06022952 1.0 Pa Pa4 1 0.00000000 0.00000000 0.50000000 1.0 V V5 1 0.82693080 0.17306920 0.23976533 1.0 V V6 1 0.82693080 0.65386261 0.23976533 1.0 V V7 1 0.34613739 0.17306920 0.23976533 1.0 V V8 1 0.17306920 0.82693080 0.76023467 1.0 V V9 1 0.17306920 0.34613739 0.76023467 1.0 V V10 1 0.65386261 0.82693080 0.76023467 1.0 Mo Mo11 1 0.00000000 0.00000000 0.00000000 1.0