# generated using pymatgen data_Zr8Sc16As7P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.01066910 _cell_length_b 10.99888196 _cell_length_c 5.50462629 _cell_angle_alpha 90.10464273 _cell_angle_beta 90.04781447 _cell_angle_gamma 89.98985050 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8Sc16As7P _chemical_formula_sum 'Zr8 Sc16 As7 P1' _cell_volume 666.63668662 _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 0.89583813 0.41970742 0.03864953 1.0 Zr Zr1 1 0.92120397 0.60830392 0.54089363 1.0 Zr Zr2 1 0.07959751 0.39600417 0.53460629 1.0 Zr Zr3 1 0.10459850 0.58277622 0.02981861 1.0 Zr Zr4 1 0.60498694 0.08003613 0.46406376 1.0 Zr Zr5 1 0.57962577 0.89546488 0.96428254 1.0 Zr Zr6 1 0.41984407 0.10495144 0.96343502 1.0 Zr Zr7 1 0.39504586 0.91956142 0.46295309 1.0 Sc Sc8 1 0.03191029 0.85823765 0.28239009 1.0 Sc Sc9 1 0.35934981 0.46886404 0.78208260 1.0 Sc Sc10 1 0.64058865 0.53245502 0.78420996 1.0 Sc Sc11 1 0.96862659 0.14035374 0.28429571 1.0 Sc Sc12 1 0.46753816 0.64078983 0.21722142 1.0 Sc Sc13 1 0.13935904 0.02691994 0.71740274 1.0 Sc Sc14 1 0.86288101 0.96431184 0.71795291 1.0 Sc Sc15 1 0.53151984 0.36007349 0.21709423 1.0 Sc Sc16 1 0.28320386 0.82556624 0.98017587 1.0 Sc Sc17 1 0.32578429 0.21390516 0.48254161 1.0 Sc Sc18 1 0.67353569 0.78621160 0.48172675 1.0 Sc Sc19 1 0.71404812 0.17253462 0.97999919 1.0 Sc Sc20 1 0.21114078 0.67482133 0.52196135 1.0 Sc Sc21 1 0.17339073 0.28603945 0.01649404 1.0 Sc Sc22 1 0.82976389 0.71424566 0.01669855 1.0 Sc Sc23 1 0.78647109 0.32788168 0.51910931 1.0 As As24 1 0.54363494 0.29751564 0.71161196 1.0 As As25 1 0.79752307 0.95622093 0.21132662 1.0 As As26 1 0.20250509 0.04330673 0.21121731 1.0 As As27 1 0.45610374 0.70303065 0.71151408 1.0 As As28 1 0.95662909 0.20211453 0.78822409 1.0 As As29 1 0.70352043 0.54485828 0.28935710 1.0 As As30 1 0.29641873 0.45751711 0.28740453 1.0 P P31 1 0.04381332 0.79542022 0.78928852 1.0