# generated using pymatgen data_Pr4GeI6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.40877308 _cell_length_b 14.52405214 _cell_length_c 15.34167254 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr4GeI6 _chemical_formula_sum 'Pr8 Ge2 I12' _cell_volume 982.37715365 _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 Pr Pr0 1 0.50000000 0.11578178 0.34478450 1.0 Pr Pr1 1 0.50000000 0.88421822 0.65521550 1.0 Pr Pr2 1 0.50000000 0.61578178 0.15521550 1.0 Pr Pr3 1 0.50000000 0.38421822 0.84478450 1.0 Pr Pr4 1 0.00000000 0.11373360 0.57603420 1.0 Pr Pr5 1 0.00000000 0.88626640 0.42396580 1.0 Pr Pr6 1 0.00000000 0.61373360 0.92396580 1.0 Pr Pr7 1 0.00000000 0.38626640 0.07603420 1.0 Ge Ge8 1 0.50000000 0.00000000 0.50000000 1.0 Ge Ge9 1 0.50000000 0.50000000 0.00000000 1.0 I I10 1 0.50000000 0.24531716 0.16311417 1.0 I I11 1 0.50000000 0.75468284 0.83688583 1.0 I I12 1 0.50000000 0.74531716 0.33688583 1.0 I I13 1 0.50000000 0.25468284 0.66311417 1.0 I I14 1 0.00000000 0.25881101 0.41448636 1.0 I I15 1 0.00000000 0.74118899 0.58551364 1.0 I I16 1 0.00000000 0.75881101 0.08551364 1.0 I I17 1 0.00000000 0.24118899 0.91448636 1.0 I I18 1 0.00000000 0.99839898 0.24029729 1.0 I I19 1 0.00000000 0.00160102 0.75970271 1.0 I I20 1 0.00000000 0.49839898 0.25970271 1.0 I I21 1 0.00000000 0.50160102 0.74029729 1.0