# generated using pymatgen data_Sr2Nd2MnCuO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.83667072 _cell_length_b 15.32540600 _cell_length_c 6.93686718 _cell_angle_alpha 106.64069200 _cell_angle_beta 106.14999145 _cell_angle_gamma 89.97652921 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2Nd2MnCuO8 _chemical_formula_sum 'Sr4 Nd4 Mn2 Cu2 O16' _cell_volume 373.97929788 _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 Sr Sr0 1 0.35844400 0.34020200 0.71473300 1.0 Sr Sr1 1 0.35494700 0.59161800 0.71132900 1.0 Sr Sr2 1 0.64494800 0.15838900 0.28858300 1.0 Sr Sr3 1 0.64152800 0.40977700 0.28517800 1.0 Nd Nd4 1 0.36574000 0.08586000 0.72784100 1.0 Nd Nd5 1 0.35169400 0.83784900 0.71956300 1.0 Nd Nd6 1 0.63425400 0.66415100 0.27217500 1.0 Nd Nd7 1 0.64844000 0.91212500 0.28054200 1.0 Mn Mn8 1 0.00280900 0.24854300 0.00135800 1.0 Mn Mn9 1 0.99731500 0.50143700 0.99859600 1.0 Cu Cu10 1 0.00332500 0.99829100 0.00170700 1.0 Cu Cu11 1 0.99673700 0.75180600 0.99840900 1.0 O O12 1 0.99640000 0.12119100 0.99123900 1.0 O O13 1 0.99997600 0.37498900 0.99991600 1.0 O O14 1 0.00363800 0.62880800 0.00877100 1.0 O O15 1 0.00010700 0.87498300 0.00006800 1.0 O O16 1 0.18727100 0.03063000 0.36416800 1.0 O O17 1 0.16224100 0.28746200 0.31556500 1.0 O O18 1 0.15840700 0.55124300 0.31986700 1.0 O O19 1 0.16487500 0.79690300 0.35748800 1.0 O O20 1 0.49819100 0.99447200 0.99092400 1.0 O O21 1 0.49597800 0.24402600 0.99003700 1.0 O O22 1 0.50373700 0.50596300 0.00985900 1.0 O O23 1 0.50205000 0.75557400 0.00923800 1.0 O O24 1 0.84161700 0.19870100 0.68006600 1.0 O O25 1 0.83759500 0.46254900 0.68433500 1.0 O O26 1 0.81257400 0.71935300 0.63574300 1.0 O O27 1 0.83516200 0.95310400 0.64270600 1.0