# generated using pymatgen data_VNiAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.69975700 _cell_length_b 6.02454600 _cell_length_c 7.12059400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural VNiAs _chemical_formula_sum 'V4 Ni4 As4' _cell_volume 158.71345627 _cell_formula_units_Z 4 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 V V0 1 0.75000000 0.97317300 0.67004800 1.0 V V1 1 0.75000000 0.47317300 0.82995200 1.0 V V2 1 0.25000000 0.02682700 0.32995200 1.0 V V3 1 0.25000000 0.52682700 0.17004800 1.0 Ni Ni4 1 0.75000000 0.85375100 0.06350300 1.0 Ni Ni5 1 0.75000000 0.35375100 0.43649700 1.0 Ni Ni6 1 0.25000000 0.14624900 0.93649700 1.0 Ni Ni7 1 0.25000000 0.64624900 0.56350300 1.0 As As8 1 0.75000000 0.74007100 0.37648900 1.0 As As9 1 0.75000000 0.24007100 0.12351100 1.0 As As10 1 0.25000000 0.25992900 0.62351100 1.0 As As11 1 0.25000000 0.75992900 0.87648900 1.0