# generated using pymatgen data_Li4Ca3PrSi8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.81961354 _cell_length_b 7.92150902 _cell_length_c 10.64707400 _cell_angle_alpha 89.85890362 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ca3PrSi8 _chemical_formula_sum 'Li4 Ca3 Pr1 Si8' _cell_volume 322.14863908 _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 0.25000000 0.99809110 0.38854790 1.0 Li Li1 1 0.75000000 0.00048426 0.60954469 1.0 Li Li2 1 0.25000000 0.49831745 0.11111689 1.0 Li Li3 1 0.75000000 0.50534696 0.88887611 1.0 Ca Ca4 1 0.75000000 0.86675769 0.13442966 1.0 Ca Ca5 1 0.25000000 0.63402540 0.63603958 1.0 Ca Ca6 1 0.75000000 0.36439683 0.36547344 1.0 Pr Pr7 1 0.25000000 0.13321563 0.86577016 1.0 Si Si8 1 0.75000000 0.26948272 0.06984908 1.0 Si Si9 1 0.25000000 0.73352877 0.93068591 1.0 Si Si10 1 0.75000000 0.76691367 0.43053916 1.0 Si Si11 1 0.25000000 0.23186770 0.56900305 1.0 Si Si12 1 0.75000000 0.83478361 0.82426197 1.0 Si Si13 1 0.25000000 0.16560142 0.17381780 1.0 Si Si14 1 0.75000000 0.33200793 0.67571321 1.0 Si Si15 1 0.25000000 0.66517788 0.32633238 1.0