# generated using pymatgen data_CaMn16O32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.90713501 _cell_length_b 9.85362251 _cell_length_c 9.97251970 _cell_angle_alpha 89.98657980 _cell_angle_beta 89.99536397 _cell_angle_gamma 90.00006815 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaMn16O32 _chemical_formula_sum 'Ca1 Mn16 O32' _cell_volume 580.46722988 _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 0.00005900 0.49651600 0.42693700 1.0 Mn Mn1 1 0.50010200 0.17135500 0.35337900 1.0 Mn Mn2 1 0.00001100 0.16347900 0.34645500 1.0 Mn Mn3 1 0.49986800 0.34908300 0.83209800 1.0 Mn Mn4 1 0.00008900 0.34729700 0.83365100 1.0 Mn Mn5 1 0.00015000 0.65655000 0.15630000 1.0 Mn Mn6 1 0.50004400 0.64725600 0.16695800 1.0 Mn Mn7 1 0.99999600 0.83321900 0.64747600 1.0 Mn Mn8 1 0.49982100 0.83092300 0.64511700 1.0 Mn Mn9 1 0.75067300 0.66676700 0.84549400 1.0 Mn Mn10 1 0.24917900 0.66678800 0.84557700 1.0 Mn Mn11 1 0.75157900 0.84753400 0.33192700 1.0 Mn Mn12 1 0.24846200 0.84728100 0.33194300 1.0 Mn Mn13 1 0.75006300 0.15093300 0.66522700 1.0 Mn Mn14 1 0.24981000 0.15104600 0.66522500 1.0 Mn Mn15 1 0.75073700 0.33099300 0.14913400 1.0 Mn Mn16 1 0.24943800 0.33102700 0.14891300 1.0 O O17 1 0.74907900 0.95686600 0.65785100 1.0 O O18 1 0.25068200 0.95687300 0.65785000 1.0 O O19 1 0.75245700 0.66443100 0.03619300 1.0 O O20 1 0.24750200 0.66440800 0.03625100 1.0 O O21 1 0.74905300 0.33303800 0.95518900 1.0 O O22 1 0.25091300 0.33303800 0.95521300 1.0 O O23 1 0.75361200 0.04090000 0.33972900 1.0 O O24 1 0.24655700 0.04087500 0.33976400 1.0 O O25 1 0.00004300 0.45778500 0.16545900 1.0 O O26 1 0.50010900 0.45359800 0.16286700 1.0 O O27 1 0.99995500 0.17349600 0.54166600 1.0 O O28 1 0.49996400 0.17264700 0.54434000 1.0 O O29 1 0.50005300 0.82929600 0.45382600 1.0 O O30 1 0.99999700 0.82761100 0.45527500 1.0 O O31 1 0.49997000 0.54222700 0.83121900 1.0 O O32 1 0.99990700 0.54151000 0.82899400 1.0 O O33 1 0.49991200 0.79610000 0.83667100 1.0 O O34 1 0.99988600 0.79639600 0.83840700 1.0 O O35 1 0.00005600 0.84683000 0.20219600 1.0 O O36 1 0.50005800 0.83968100 0.20534100 1.0 O O37 1 0.00014600 0.20140000 0.15389300 1.0 O O38 1 0.50006000 0.20319400 0.16064200 1.0 O O39 1 0.49993600 0.15531500 0.79309500 1.0 O O40 1 0.99993100 0.15381800 0.79278400 1.0 O O41 1 0.76760400 0.30737600 0.34362900 1.0 O O42 1 0.23264800 0.30736500 0.34367800 1.0 O O43 1 0.75278800 0.34594600 0.70272000 1.0 O O44 1 0.24709900 0.34598900 0.70271500 1.0 O O45 1 0.75284500 0.70137400 0.64782700 1.0 O O46 1 0.24695000 0.70139400 0.64786200 1.0 O O47 1 0.76782500 0.64843100 0.29759600 1.0 O O48 1 0.23232500 0.64840500 0.29754900 1.0