data_global _amcsd_formula_title 'Pd(NH3)4(CrO4)' loop_ _publ_author_name 'Laligant Y' _journal_name_full 'European Journal of Solid State and Inorganic Chemistry' _journal_volume 30 _journal_year 1993 _journal_page_first 681 _journal_page_last 688 _publ_section_title ; On the first palladium chromate: crystal structure of Pd(NH3)4(CrO4) _cod_database_code 1000344 ; _database_code_amcsd 0012584 _chemical_formula_sum 'Pd Cr O4 N4 H12' _cell_length_a 7.3177 _cell_length_b 7.3177 _cell_length_c 15.289 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 818.707 _exptl_crystal_density_diffrn 2.357 _symmetry_space_group_name_H-M 'I 41/a m d' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '1/4-y,3/4-x,1/4+z' '3/4-y,1/4-x,3/4+z' '1/4+y,3/4+x,1/4-z' '3/4+y,1/4+x,3/4-z' '1/4+y,3/4-x,1/4-z' '3/4+y,1/4-x,3/4-z' '1/4-y,3/4+x,1/4+z' '3/4-y,1/4+x,3/4+z' '1/2+x,-y,1/2+z' '+x,1/2-y,+z' '1/2-x,y,1/2-z' '-x,1/2+y,-z' '1/2+x,y,1/2-z' '+x,1/2+y,-z' '1/2-x,-y,1/2+z' '-x,1/2-y,+z' '1/4+y,1/4+x,3/4+z' '3/4+y,3/4+x,1/4+z' '1/4-y,1/4-x,3/4-z' '3/4-y,3/4-x,1/4-z' '1/4-y,1/4+x,3/4-z' '3/4-y,3/4+x,1/4-z' '1/4+y,1/4-x,3/4+z' '3/4+y,3/4-x,1/4+z' '-x,y,z' '1/2-x,1/2+y,1/2+z' 'x,-y,-z' '1/2+x,1/2-y,1/2-z' '-x,-y,-z' '1/2-x,1/2-y,1/2-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Pd1 0.00000 0.25000 0.37500 Cr1 0.00000 0.75000 0.12500 O1 0.00000 0.43460 0.81350 N1 0.00000 0.47130 0.62680 H1 0.00000 0.43500 0.69400 H2 0.12600 0.41900 0.59500 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Pd1 0.01440 0.01440 0.02240 0.00000 0.00000 0.00000 Cr1 0.01830 0.01830 0.02310 0.00000 0.00000 0.00000 O1 0.06350 0.02780 0.03780 0.00000 0.00000 0.00690 N1 0.03300 0.01700 0.04320 0.00000 0.00000 0.00130