# generated using pymatgen data_Pr2Sc3Ga4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.44068090 _cell_length_b 7.66532191 _cell_length_c 14.70744802 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2Sc3Ga4 _chemical_formula_sum 'Pr8 Sc12 Ga16' _cell_volume 838.84244992 _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 Pr Pr0 1 0.01421986 0.17581362 0.40338791 1.0 Pr Pr1 1 0.51421986 0.32418638 0.40338791 1.0 Pr Pr2 1 0.48578014 0.67581362 0.90338791 1.0 Pr Pr3 1 0.48578014 0.67581362 0.59661209 1.0 Pr Pr4 1 0.98578014 0.82418638 0.59661209 1.0 Pr Pr5 1 0.98578014 0.82418638 0.90338791 1.0 Pr Pr6 1 0.51421986 0.32418638 0.09661209 1.0 Pr Pr7 1 0.01421986 0.17581362 0.09661209 1.0 Sc Sc8 1 0.33056515 0.17283967 0.62525680 1.0 Sc Sc9 1 0.66943485 0.82716033 0.37474320 1.0 Sc Sc10 1 0.66063734 0.00282063 0.75000000 1.0 Sc Sc11 1 0.16943485 0.67283967 0.37474320 1.0 Sc Sc12 1 0.83056515 0.32716033 0.87474320 1.0 Sc Sc13 1 0.83056515 0.32716033 0.62525680 1.0 Sc Sc14 1 0.83936266 0.50282063 0.25000000 1.0 Sc Sc15 1 0.33936266 0.99717937 0.25000000 1.0 Sc Sc16 1 0.33056515 0.17283967 0.87474320 1.0 Sc Sc17 1 0.16943485 0.67283967 0.12525680 1.0 Sc Sc18 1 0.66943485 0.82716033 0.12525680 1.0 Sc Sc19 1 0.16063734 0.49717937 0.75000000 1.0 Ga Ga20 1 0.28297041 0.88274073 0.75000000 1.0 Ga Ga21 1 0.46688614 0.62297162 0.25000000 1.0 Ga Ga22 1 0.03311386 0.12297162 0.75000000 1.0 Ga Ga23 1 0.53311386 0.37702838 0.75000000 1.0 Ga Ga24 1 0.15478041 0.46153976 0.54047076 1.0 Ga Ga25 1 0.96688614 0.87702838 0.25000000 1.0 Ga Ga26 1 0.71702959 0.11725927 0.25000000 1.0 Ga Ga27 1 0.84521959 0.53846024 0.04047076 1.0 Ga Ga28 1 0.34521959 0.96153976 0.04047076 1.0 Ga Ga29 1 0.15478041 0.46153976 0.95952924 1.0 Ga Ga30 1 0.65478041 0.03846024 0.54047076 1.0 Ga Ga31 1 0.34521959 0.96153976 0.45952924 1.0 Ga Ga32 1 0.84521959 0.53846024 0.45952924 1.0 Ga Ga33 1 0.78297041 0.61725927 0.75000000 1.0 Ga Ga34 1 0.21702959 0.38274073 0.25000000 1.0 Ga Ga35 1 0.65478041 0.03846024 0.95952924 1.0