# generated using pymatgen data_La14Mn16O45 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.62377179 _cell_length_b 5.60114996 _cell_length_c 31.34142626 _cell_angle_alpha 89.41039523 _cell_angle_beta 90.29322811 _cell_angle_gamma 90.33333623 _symmetry_Int_Tables_number 1 _chemical_formula_structural La14Mn16O45 _chemical_formula_sum 'La14 Mn16 O45' _cell_volume 987.16044279 _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 La La0 1 0.99226800 0.97767400 0.17632100 1.0 La La1 1 0.00278400 0.98782300 0.42764500 1.0 La La2 1 0.00772000 0.97002500 0.68736200 1.0 La La3 1 0.00933900 0.97567900 0.94648500 1.0 La La4 1 0.49441200 0.48694900 0.43331900 1.0 La La5 1 0.51646500 0.48422900 0.18498500 1.0 La La6 1 0.49068300 0.46936500 0.68752800 1.0 La La7 1 0.49727800 0.47583700 0.94172600 1.0 La La8 1 0.52038000 0.52844400 0.06183900 1.0 La La9 1 0.51417900 0.53522500 0.31374600 1.0 La La10 1 0.50764300 0.53158300 0.81489900 1.0 La La11 1 0.50617000 0.53309800 0.55981700 1.0 La La12 1 0.99131100 0.03097500 0.81607800 1.0 La La13 1 0.98993700 0.03265200 0.55876400 1.0 Mn Mn14 1 0.00332500 0.48602800 0.12587100 1.0 Mn Mn15 1 0.99499200 0.50349400 0.37344500 1.0 Mn Mn16 1 0.99847600 0.50111900 0.62377400 1.0 Mn Mn17 1 0.00120400 0.50066600 0.87755400 1.0 Mn Mn18 1 0.99982500 0.49029500 0.00147500 1.0 Mn Mn19 1 0.98521000 0.50751300 0.25020900 1.0 Mn Mn20 1 0.99860300 0.50546800 0.49722700 1.0 Mn Mn21 1 0.99849000 0.50113300 0.75130200 1.0 Mn Mn22 1 0.50102400 0.01163200 0.36907300 1.0 Mn Mn23 1 0.49718300 0.99974400 0.12301300 1.0 Mn Mn24 1 0.50973400 0.99783600 0.00524800 1.0 Mn Mn25 1 0.49875900 0.00143700 0.62357800 1.0 Mn Mn26 1 0.52789700 0.99505800 0.25297700 1.0 Mn Mn27 1 0.49692600 0.00034700 0.87832100 1.0 Mn Mn28 1 0.49957100 0.00059200 0.75133500 1.0 Mn Mn29 1 0.49396200 0.00467900 0.49630200 1.0 O O30 1 0.07867900 0.48517300 0.55908700 1.0 O O31 1 0.08024100 0.48410100 0.81562900 1.0 O O32 1 0.21301600 0.22112800 0.48559200 1.0 O O33 1 0.22180000 0.21828400 0.73986600 1.0 O O34 1 0.23796600 0.24080100 0.99316400 1.0 O O35 1 0.24012600 0.23541500 0.13253200 1.0 O O36 1 0.23874000 0.25892200 0.38158600 1.0 O O37 1 0.21771400 0.21906300 0.63488500 1.0 O O38 1 0.21413200 0.21596800 0.88896900 1.0 O O39 1 0.29331900 0.66878900 0.24520300 1.0 O O40 1 0.26381000 0.71820400 0.13420200 1.0 O O41 1 0.26292700 0.73156400 0.37994800 1.0 O O42 1 0.27630500 0.72306400 0.48697300 1.0 O O43 1 0.28140800 0.71806900 0.63482900 1.0 O O44 1 0.27935400 0.71791700 0.88789200 1.0 O O45 1 0.27937300 0.71804900 0.73999000 1.0 O O46 1 0.27302700 0.71292700 0.99443700 1.0 O O47 1 0.44589200 0.95618100 0.06389500 1.0 O O48 1 0.42045900 0.01156000 0.30919700 1.0 O O49 1 0.42056800 0.98709400 0.81493300 1.0 O O50 1 0.41931300 0.98886900 0.56035000 1.0 O O51 1 0.57021000 0.01346800 0.43298200 1.0 O O52 1 0.58023200 0.01675500 0.68729800 1.0 O O53 1 0.54320300 0.02173000 0.18987600 1.0 O O54 1 0.57696900 0.00998600 0.94123300 1.0 O O55 1 0.72517400 0.28497000 0.01047400 1.0 O O56 1 0.72752000 0.27865500 0.11842000 1.0 O O57 1 0.69481800 0.30992200 0.25735700 1.0 O O58 1 0.72010500 0.28351100 0.76221000 1.0 O O59 1 0.71867000 0.28272500 0.86652800 1.0 O O60 1 0.73146100 0.28537100 0.36545800 1.0 O O61 1 0.71646600 0.28570200 0.50813700 1.0 O O62 1 0.71704000 0.28471600 0.61295400 1.0 O O63 1 0.76138300 0.74631900 0.12689600 1.0 O O64 1 0.77726000 0.77859400 0.86616300 1.0 O O65 1 0.77174700 0.74295000 0.01085800 1.0 O O66 1 0.78876700 0.77580300 0.25856300 1.0 O O67 1 0.75562900 0.75086000 0.36438700 1.0 O O68 1 0.78186700 0.78456600 0.61285900 1.0 O O69 1 0.77850100 0.78394500 0.76230300 1.0 O O70 1 0.77243800 0.78218400 0.50875400 1.0 O O71 1 0.96419600 0.44109800 0.18975100 1.0 O O72 1 0.92151800 0.51572600 0.68770600 1.0 O O73 1 0.92681000 0.51352100 0.93714900 1.0 O O74 1 0.92319700 0.52237900 0.43763300 1.0