# generated using pymatgen data_Li3Y5(Ni4As3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.48126625 _cell_length_b 12.48126664 _cell_length_c 3.89569192 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000415 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3Y5(Ni4As3)4 _chemical_formula_sum 'Li3 Y5 Ni16 As12' _cell_volume 525.57237193 _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 Li Li0 1 0.56753819 0.56753819 0.00000000 1.0 Li Li1 1 0.43246181 0.00000000 0.00000000 1.0 Li Li2 1 0.00000000 0.43246181 0.00000000 1.0 Y Y3 1 0.18873573 0.18873573 0.50000000 1.0 Y Y4 1 0.81126427 1.00000000 0.50000000 1.0 Y Y5 1 1.00000000 0.81126427 0.50000000 1.0 Y Y6 1 0.33333300 0.66666700 0.00000000 1.0 Y Y7 1 0.66666700 0.33333300 0.00000000 1.0 Ni Ni8 1 0.72018527 0.72018527 0.50000000 1.0 Ni Ni9 1 0.27981473 0.00000000 0.50000000 1.0 Ni Ni10 1 0.00000000 0.27981473 0.50000000 1.0 Ni Ni11 1 0.18539909 0.38089606 0.00000000 1.0 Ni Ni12 1 0.61910394 0.80450303 0.00000000 1.0 Ni Ni13 1 0.19549697 0.81460091 0.00000000 1.0 Ni Ni14 1 0.80450303 0.61910394 0.00000000 1.0 Ni Ni15 1 0.81460091 0.19549697 0.00000000 1.0 Ni Ni16 1 0.38089606 0.18539909 0.00000000 1.0 Ni Ni17 1 0.35945983 0.48090928 0.50000000 1.0 Ni Ni18 1 0.51909072 0.87855155 0.50000000 1.0 Ni Ni19 1 0.12144845 0.64054017 0.50000000 1.0 Ni Ni20 1 0.87855155 0.51909072 0.50000000 1.0 Ni Ni21 1 0.64054017 0.12144845 0.50000000 1.0 Ni Ni22 1 0.48090928 0.35945983 0.50000000 1.0 Ni Ni23 1 0.00000000 0.00000000 0.00000000 1.0 As As24 1 0.82127489 0.82127489 0.00000000 1.0 As As25 1 0.17872511 0.00000000 0.00000000 1.0 As As26 1 0.00000000 0.17872511 0.00000000 1.0 As As27 1 0.16843830 0.47844174 0.50000000 1.0 As As28 1 0.52155826 0.68999557 0.50000000 1.0 As As29 1 0.31000443 0.83156170 0.50000000 1.0 As As30 1 0.68999557 0.52155826 0.50000000 1.0 As As31 1 0.83156170 0.31000443 0.50000000 1.0 As As32 1 0.47844174 0.16843830 0.50000000 1.0 As As33 1 0.36653381 0.36653381 0.00000000 1.0 As As34 1 0.63346619 0.00000000 0.00000000 1.0 As As35 1 0.00000000 0.63346619 0.00000000 1.0