# generated using pymatgen data_Mn2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.41886143 _cell_length_b 9.42071325 _cell_length_c 9.41927971 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2O3 _chemical_formula_sum 'Mn32 O48' _cell_volume 835.79522593 _cell_formula_units_Z 16 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 Mn Mn0 1 0.50000000 0.50000000 -0.00000000 1.0 Mn Mn1 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn2 1 -0.00000000 0.50000000 0.50000000 1.0 Mn Mn3 1 -0.00000000 0.00000000 -0.00000000 1.0 Mn Mn4 1 -0.00000000 0.00000000 0.50000000 1.0 Mn Mn5 1 -0.00000000 0.50000000 -0.00000000 1.0 Mn Mn6 1 0.50000000 0.00000000 -0.00000000 1.0 Mn Mn7 1 0.50000000 0.50000000 0.50000000 1.0 Mn Mn8 1 0.50089599 0.75084194 0.28508742 1.0 Mn Mn9 1 0.49910401 0.25084194 0.21491258 1.0 Mn Mn10 1 0.99910401 0.24915806 0.78508742 1.0 Mn Mn11 1 0.00089599 0.74915806 0.71491258 1.0 Mn Mn12 1 0.49910401 0.24915806 0.71491258 1.0 Mn Mn13 1 0.50089599 0.74915806 0.78508742 1.0 Mn Mn14 1 0.00089599 0.75084194 0.21491258 1.0 Mn Mn15 1 0.99910401 0.25084194 0.28508742 1.0 Mn Mn16 1 0.25029962 0.78500933 0.99962592 1.0 Mn Mn17 1 0.74970038 0.28500933 0.50037408 1.0 Mn Mn18 1 0.24970038 0.21499067 0.49962592 1.0 Mn Mn19 1 0.75029962 0.71499067 0.00037408 1.0 Mn Mn20 1 0.74970038 0.21499067 0.00037408 1.0 Mn Mn21 1 0.25029962 0.71499067 0.49962592 1.0 Mn Mn22 1 0.75029962 0.78500933 0.50037408 1.0 Mn Mn23 1 0.24970038 0.28500933 0.99962592 1.0 Mn Mn24 1 0.21497103 0.50129659 0.24944083 1.0 Mn Mn25 1 0.78502897 0.00129659 0.25055917 1.0 Mn Mn26 1 0.28502897 0.49870341 0.74944083 1.0 Mn Mn27 1 0.71497103 0.99870341 0.75055917 1.0 Mn Mn28 1 0.78502897 0.49870341 0.75055917 1.0 Mn Mn29 1 0.21497103 0.99870341 0.74944083 1.0 Mn Mn30 1 0.71497103 0.50129659 0.25055917 1.0 Mn Mn31 1 0.28502897 0.00129659 0.24944083 1.0 O O32 1 0.14485181 0.91734147 0.12818543 1.0 O O33 1 0.85514819 0.41734147 0.37181457 1.0 O O34 1 0.35514819 0.08265853 0.62818543 1.0 O O35 1 0.64485181 0.58265853 0.87181457 1.0 O O36 1 0.85514819 0.08265853 0.87181457 1.0 O O37 1 0.14485181 0.58265853 0.62818543 1.0 O O38 1 0.64485181 0.91734147 0.37181457 1.0 O O39 1 0.35514819 0.41734147 0.12818543 1.0 O O40 1 0.08380086 0.62943572 0.35492280 1.0 O O41 1 0.91619914 0.12943572 0.14507720 1.0 O O42 1 0.41619914 0.37056428 0.85492280 1.0 O O43 1 0.58380086 0.87056428 0.64507720 1.0 O O44 1 0.91619914 0.37056428 0.64507720 1.0 O O45 1 0.08380086 0.87056428 0.85492280 1.0 O O46 1 0.58380086 0.62943572 0.14507720 1.0 O O47 1 0.41619914 0.12943572 0.35492280 1.0 O O48 1 0.37245075 0.85623972 0.41716562 1.0 O O49 1 0.62754925 0.35623972 0.08283438 1.0 O O50 1 0.12754925 0.14376028 0.91716562 1.0 O O51 1 0.87245075 0.64376028 0.58283438 1.0 O O52 1 0.62754925 0.14376028 0.58283438 1.0 O O53 1 0.37245075 0.64376028 0.91716562 1.0 O O54 1 0.87245075 0.85623972 0.08283438 1.0 O O55 1 0.12754925 0.35623972 0.41716562 1.0 O O56 1 0.35556778 0.58398310 0.37125191 1.0 O O57 1 0.64443222 0.08398310 0.12874809 1.0 O O58 1 0.14443222 0.41601690 0.87125191 1.0 O O59 1 0.85556778 0.91601690 0.62874809 1.0 O O60 1 0.64443222 0.41601690 0.62874809 1.0 O O61 1 0.35556778 0.91601690 0.87125191 1.0 O O62 1 0.85556778 0.58398310 0.12874809 1.0 O O63 1 0.14443222 0.08398310 0.37125191 1.0 O O64 1 0.41743742 0.87268046 0.14439922 1.0 O O65 1 0.58256258 0.37268046 0.35560078 1.0 O O66 1 0.08256258 0.12731954 0.64439922 1.0 O O67 1 0.91743742 0.62731954 0.85560078 1.0 O O68 1 0.58256258 0.12731954 0.85560078 1.0 O O69 1 0.41743742 0.62731954 0.64439922 1.0 O O70 1 0.91743742 0.87268046 0.35560078 1.0 O O71 1 0.08256258 0.37268046 0.14439922 1.0 O O72 1 0.12959273 0.64547458 0.08361763 1.0 O O73 1 0.87040727 0.14547458 0.41638237 1.0 O O74 1 0.37040727 0.35452542 0.58361763 1.0 O O75 1 0.62959273 0.85452542 0.91638237 1.0 O O76 1 0.87040727 0.35452542 0.91638237 1.0 O O77 1 0.12959273 0.85452542 0.58361763 1.0 O O78 1 0.62959273 0.64547458 0.41638237 1.0 O O79 1 0.37040727 0.14547458 0.08361763 1.0