# generated using pymatgen data_MnCd4O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.57434164 _cell_length_b 7.40422059 _cell_length_c 10.95179900 _cell_angle_alpha 78.10462369 _cell_angle_beta 90.00154702 _cell_angle_gamma 77.16849482 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnCd4O5 _chemical_formula_sum 'Mn4 Cd16 O20' _cell_volume 508.04834215 _cell_formula_units_Z 4 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 0.10026292 0.59989420 0.59917356 1.0 Mn Mn1 1 -0.00009345 0.00004620 0.00086577 1.0 Mn Mn2 1 0.60026279 0.59989462 0.59917365 1.0 Mn Mn3 1 0.49990661 0.00004505 0.00086565 1.0 Cd Cd4 1 0.79999724 0.80000699 0.80000783 1.0 Cd Cd5 1 0.30000082 0.80000629 0.80000920 1.0 Cd Cd6 1 0.04992050 0.80005199 0.29994084 1.0 Cd Cd7 1 0.54992034 0.80005000 0.29994206 1.0 Cd Cd8 1 0.14896126 0.40435601 0.89510914 1.0 Cd Cd9 1 0.64895841 0.40435733 0.89510730 1.0 Cd Cd10 1 0.95103140 0.19559967 0.70488827 1.0 Cd Cd11 1 0.45103084 0.19559899 0.70488710 1.0 Cd Cd12 1 0.84989681 0.59974283 0.09872102 1.0 Cd Cd13 1 0.34989815 0.59974106 0.09872194 1.0 Cd Cd14 1 0.24996436 0.00029419 0.50128697 1.0 Cd Cd15 1 0.74996394 0.00029500 0.50128713 1.0 Cd Cd16 1 0.90037510 0.39848232 0.40359305 1.0 Cd Cd17 1 0.40037531 0.39848088 0.40359351 1.0 Cd Cd18 1 0.19967236 0.20156282 0.19637342 1.0 Cd Cd19 1 0.69967236 0.20156193 0.19637274 1.0 O O20 1 0.02705936 0.89174040 0.64909571 1.0 O O21 1 0.52706049 0.89173823 0.64909559 1.0 O O22 1 0.07288254 0.70826912 0.95094822 1.0 O O23 1 0.57288029 0.70827077 0.95094762 1.0 O O24 1 0.87294526 0.50814887 0.73590765 1.0 O O25 1 0.37294402 0.50814970 0.73590748 1.0 O O26 1 0.22722687 0.09180812 0.86409517 1.0 O O27 1 0.72721957 0.09180695 0.86409446 1.0 O O28 1 0.77271320 0.90805706 0.13766460 1.0 O O29 1 0.27271909 0.90805607 0.13766543 1.0 O O30 1 0.82708327 0.69199987 0.46231081 1.0 O O31 1 0.32708183 0.69199889 0.46231130 1.0 O O32 1 0.12445893 0.50205266 0.25139730 1.0 O O33 1 0.62445908 0.50205096 0.25139761 1.0 O O34 1 0.97555095 0.09795796 0.34860710 1.0 O O35 1 0.47555191 0.09795547 0.34860679 1.0 O O36 1 0.17351993 0.30600127 0.55596656 1.0 O O37 1 0.67352022 0.30600220 0.55596697 1.0 O O38 1 0.92657086 0.29393418 0.04404470 1.0 O O39 1 0.42657226 0.29393388 0.04404579 1.0