# generated using pymatgen data_Er5Zr3(Ni4As3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.75037864 _cell_length_b 12.75037864 _cell_length_c 3.91094600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000334 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er5Zr3(Ni4As3)4 _chemical_formula_sum 'Er5 Zr3 Ni16 As12' _cell_volume 550.62839152 _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 Er Er0 1 0.81652500 0.00000000 0.50000000 1.0 Er Er1 1 0.18347500 0.18347500 0.50000000 1.0 Er Er2 1 0.00000000 0.81652500 0.50000000 1.0 Er Er3 1 0.66666700 0.33333300 0.00000000 1.0 Er Er4 1 0.33333300 0.66666700 0.00000000 1.0 Zr Zr5 1 0.56237700 0.56237700 0.00000000 1.0 Zr Zr6 1 0.00000000 0.43762300 0.00000000 1.0 Zr Zr7 1 0.43762300 0.00000000 0.00000000 1.0 Ni Ni8 1 0.87868000 0.51738600 0.50000000 1.0 Ni Ni9 1 0.51738600 0.87868000 0.50000000 1.0 Ni Ni10 1 0.00000000 0.27559700 0.50000000 1.0 Ni Ni11 1 0.36129500 0.48261400 0.50000000 1.0 Ni Ni12 1 0.19266200 0.81694800 0.00000000 1.0 Ni Ni13 1 0.27559700 0.00000000 0.50000000 1.0 Ni Ni14 1 0.37571400 0.18305200 0.00000000 1.0 Ni Ni15 1 0.62428600 0.80733800 0.00000000 1.0 Ni Ni16 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni17 1 0.12132000 0.63870500 0.50000000 1.0 Ni Ni18 1 0.48261400 0.36129500 0.50000000 1.0 Ni Ni19 1 0.81694800 0.19266200 0.00000000 1.0 Ni Ni20 1 0.72440300 0.72440300 0.50000000 1.0 Ni Ni21 1 0.18305200 0.37571400 0.00000000 1.0 Ni Ni22 1 0.80733800 0.62428600 0.00000000 1.0 Ni Ni23 1 0.63870500 0.12132000 0.50000000 1.0 As As24 1 0.17757900 0.00000000 0.00000000 1.0 As As25 1 0.64554900 0.00000000 0.00000000 1.0 As As26 1 0.52005300 0.69274300 0.50000000 1.0 As As27 1 0.47994700 0.17269000 0.50000000 1.0 As As28 1 0.69274300 0.52005300 0.50000000 1.0 As As29 1 0.30725700 0.82731000 0.50000000 1.0 As As30 1 0.82731000 0.30725700 0.50000000 1.0 As As31 1 0.82242100 0.82242100 0.00000000 1.0 As As32 1 0.00000000 0.64554900 0.00000000 1.0 As As33 1 0.00000000 0.17757900 0.00000000 1.0 As As34 1 0.17269000 0.47994700 0.50000000 1.0 As As35 1 0.35445100 0.35445100 0.00000000 1.0