# generated using pymatgen data_Ca2La5Mn7NiO24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.47763900 _cell_length_b 7.69200801 _cell_length_c 10.98225388 _cell_angle_alpha 89.89745800 _cell_angle_beta 89.88456062 _cell_angle_gamma 89.99772069 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2La5Mn7NiO24 _chemical_formula_sum 'Ca2 La5 Mn7 Ni1 O24' _cell_volume 462.72507701 _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 Ca Ca0 1 0.99651000 0.75019500 0.51647200 1.0 Ca Ca1 1 0.51269400 0.75192300 0.27310500 1.0 La La2 1 0.00394200 0.24616000 0.97775400 1.0 La La3 1 0.50478100 0.75500700 0.76006100 1.0 La La4 1 0.00270600 0.24859600 0.49943200 1.0 La La5 1 0.49418900 0.24782800 0.24029700 1.0 La La6 1 0.00393100 0.75419700 0.00938300 1.0 Mn Mn7 1 0.00420400 0.49373100 0.74732400 1.0 Mn Mn8 1 0.50203300 0.50093700 0.50474600 1.0 Mn Mn9 1 0.99924500 0.50567400 0.25294700 1.0 Mn Mn10 1 0.00583100 0.00467700 0.74897000 1.0 Mn Mn11 1 0.50204800 0.99870800 0.50416000 1.0 Mn Mn12 1 0.99730900 0.99547100 0.25233800 1.0 Mn Mn13 1 0.50092500 0.49865400 0.99882900 1.0 Ni Ni14 1 0.50148600 0.00246600 0.99926100 1.0 O O15 1 0.44694400 0.74382300 0.99007300 1.0 O O16 1 0.78523000 0.96822700 0.88334100 1.0 O O17 1 0.77860200 0.53220400 0.88882000 1.0 O O18 1 0.25986800 0.47507200 0.86815300 1.0 O O19 1 0.25398100 0.01880200 0.86330600 1.0 O O20 1 0.93861700 0.24912000 0.74433400 1.0 O O21 1 0.05687400 0.74867300 0.74784800 1.0 O O22 1 0.73104900 0.95853300 0.63086300 1.0 O O23 1 0.73184800 0.54165800 0.63239000 1.0 O O24 1 0.21478800 0.48232300 0.60577800 1.0 O O25 1 0.21619700 0.01621100 0.60447700 1.0 O O26 1 0.55918900 0.24963400 0.48770800 1.0 O O27 1 0.43119600 0.75014900 0.49520100 1.0 O O28 1 0.78000300 0.53776000 0.38921200 1.0 O O29 1 0.78044300 0.96238700 0.39163300 1.0 O O30 1 0.27598200 0.46728600 0.36210100 1.0 O O31 1 0.27801000 0.03354500 0.36286300 1.0 O O32 1 0.93837200 0.25037000 0.26060800 1.0 O O33 1 0.08109200 0.75050200 0.24252700 1.0 O O34 1 0.72980200 0.96418400 0.14604100 1.0 O O35 1 0.72344000 0.54071200 0.14258600 1.0 O O36 1 0.21674300 0.46454800 0.11251600 1.0 O O37 1 0.21043000 0.03468800 0.11619900 1.0 O O38 1 0.56307200 0.25742700 0.01628400 1.0