# generated using pymatgen data_BaLaNdMn3O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.62321608 _cell_length_b 5.62321608 _cell_length_c 13.54033400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000095 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaLaNdMn3O9 _chemical_formula_sum 'Ba2 La2 Nd2 Mn6 O18' _cell_volume 370.79131169 _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 Ba Ba0 1 0.00000000 0.00000000 0.50000000 1.0 Ba Ba1 1 0.00000000 0.00000000 0.00000000 1.0 La La2 1 0.33333300 0.66666700 0.33155200 1.0 La La3 1 0.66666700 0.33333300 0.66844800 1.0 Nd Nd4 1 0.33333300 0.66666700 0.83140800 1.0 Nd Nd5 1 0.66666700 0.33333300 0.16859200 1.0 Mn Mn6 1 0.33333300 0.66666700 0.08286700 1.0 Mn Mn7 1 0.00000000 0.00000000 0.75085600 1.0 Mn Mn8 1 0.66666700 0.33333300 0.41651700 1.0 Mn Mn9 1 0.33333300 0.66666700 0.58348300 1.0 Mn Mn10 1 0.00000000 0.00000000 0.24914400 1.0 Mn Mn11 1 0.66666700 0.33333300 0.91713300 1.0 O O12 1 0.76183300 0.10401500 0.82713100 1.0 O O13 1 0.10401500 0.76183300 0.17286900 1.0 O O14 1 0.47763000 0.47763000 0.50000000 1.0 O O15 1 0.34218200 0.23816700 0.82713100 1.0 O O16 1 0.65781800 0.89598500 0.17286900 1.0 O O17 1 0.00000000 0.52237000 0.50000000 1.0 O O18 1 0.89598500 0.65781800 0.82713100 1.0 O O19 1 0.23816700 0.34218200 0.17286900 1.0 O O20 1 0.52237000 0.00000000 0.50000000 1.0 O O21 1 0.65691700 0.76878600 0.67461500 1.0 O O22 1 0.00000000 0.47542900 0.00000000 1.0 O O23 1 0.34308300 0.11186900 0.32538500 1.0 O O24 1 0.11186900 0.34308300 0.67461500 1.0 O O25 1 0.47542900 0.00000000 0.00000000 1.0 O O26 1 0.76878600 0.65691700 0.32538500 1.0 O O27 1 0.23121400 0.88813100 0.67461500 1.0 O O28 1 0.52457100 0.52457100 0.00000000 1.0 O O29 1 0.88813100 0.23121400 0.32538500 1.0