# generated using pymatgen data_Ca3Pd2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.64332013 _cell_length_b 7.64332485 _cell_length_c 7.64331714 _cell_angle_alpha 71.58364801 _cell_angle_beta 71.58366368 _cell_angle_gamma 71.58362421 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Pd2 _chemical_formula_sum 'Ca9 Pd6' _cell_volume 390.20423163 _cell_formula_units_Z 3 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 -0.00000000 0.00000000 -0.00000000 1.0 Ca Ca1 1 0.79610628 0.79610728 0.79610628 1.0 Ca Ca2 1 0.20389372 0.20389272 0.20389372 1.0 Ca Ca3 1 0.60514844 0.33168759 0.84344006 1.0 Ca Ca4 1 0.33168759 0.84344006 0.60514844 1.0 Ca Ca5 1 0.84344006 0.60514844 0.33168759 1.0 Ca Ca6 1 0.39485056 0.66831241 0.15655994 1.0 Ca Ca7 1 0.66831241 0.15655994 0.39485056 1.0 Ca Ca8 1 0.15655994 0.39485056 0.66831241 1.0 Pd Pd9 1 0.95663274 0.15377813 0.58692768 1.0 Pd Pd10 1 0.15377513 0.58692668 0.95663374 1.0 Pd Pd11 1 0.58692768 0.95663274 0.15377613 1.0 Pd Pd12 1 0.04336726 0.84622187 0.41307232 1.0 Pd Pd13 1 0.84622487 0.41307332 0.04336626 1.0 Pd Pd14 1 0.41307232 0.04336726 0.84622387 1.0