# generated using pymatgen data_Ca9Dy(Sn3H)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.41446659 _cell_length_b 9.41446626 _cell_length_c 9.42511571 _cell_angle_alpha 128.86199516 _cell_angle_beta 128.86199239 _cell_angle_gamma 75.13211435 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca9Dy(Sn3H)2 _chemical_formula_sum 'Ca9 Dy1 Sn6 H2' _cell_volume 493.37454440 _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 Ca Ca0 1 0.49882413 0.50278575 0.00141402 1.0 Ca Ca1 1 0.00278575 0.99882413 0.00141402 1.0 Ca Ca2 1 0.18676032 0.68676032 0.17527586 1.0 Ca Ca3 1 0.00929445 0.18379784 0.49770453 1.0 Ca Ca4 1 0.68379784 0.50929445 0.49770453 1.0 Ca Ca5 1 0.48942857 0.98942857 0.18009898 1.0 Ca Ca6 1 0.81060039 0.31060039 0.82143959 1.0 Ca Ca7 1 0.98645805 0.81379073 0.49815446 1.0 Ca Ca8 1 0.31379073 0.48645805 0.49815446 1.0 Dy Dy9 1 0.51500528 0.01500528 0.82379359 1.0 Sn Sn10 1 0.25548339 0.24261001 0.99330500 1.0 Sn Sn11 1 0.74261001 0.75548339 0.99330500 1.0 Sn Sn12 1 0.87056458 0.37056458 0.24216173 1.0 Sn Sn13 1 0.12277653 0.62277653 0.74731269 1.0 Sn Sn14 1 0.37255554 0.12661227 0.50597517 1.0 Sn Sn15 1 0.62661227 0.87255554 0.50597517 1.0 H H16 1 0.26301062 0.76301062 0.51452618 1.0 H H17 1 0.74964056 0.24964056 0.50228501 1.0