# generated using pymatgen data_AcNi5As3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.34725962 _cell_length_b 6.34725962 _cell_length_c 11.91366234 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 145.16259040 _symmetry_Int_Tables_number 1 _chemical_formula_structural AcNi5As3 _chemical_formula_sum 'Ac2 Ni10 As6' _cell_volume 274.18501431 _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 Ac Ac0 1 0.16580845 0.83419155 0.25000000 1.0 Ac Ac1 1 0.83419155 0.16580845 0.75000000 1.0 Ni Ni2 1 0.19243725 0.80756275 0.93178700 1.0 Ni Ni3 1 0.80756275 0.19243725 0.43178700 1.0 Ni Ni4 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni5 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni6 1 0.54653042 0.45346958 0.64594641 1.0 Ni Ni7 1 0.45346958 0.54653042 0.35405359 1.0 Ni Ni8 1 0.45346958 0.54653042 0.14594641 1.0 Ni Ni9 1 0.19243725 0.80756275 0.56821300 1.0 Ni Ni10 1 0.80756275 0.19243725 0.06821300 1.0 Ni Ni11 1 0.54653042 0.45346958 0.85405359 1.0 As As12 1 0.62123339 0.37876661 0.46350608 1.0 As As13 1 0.11100098 0.88899902 0.75000000 1.0 As As14 1 0.62123339 0.37876661 0.03649392 1.0 As As15 1 0.37876661 0.62123339 0.96350608 1.0 As As16 1 0.88899902 0.11100098 0.25000000 1.0 As As17 1 0.37876661 0.62123339 0.53649392 1.0