# generated using pymatgen data_Te2PO7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.24005000 _cell_length_b 8.37378600 _cell_length_c 9.75040900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Te2PO7 _chemical_formula_sum 'Te8 P4 O28' _cell_volume 591.13443225 _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 Te Te0 1 0.81092500 0.00253900 0.65717300 1.0 Te Te1 1 0.18907500 0.50253900 0.34282700 1.0 Te Te2 1 0.81092500 0.50253900 0.84282700 1.0 Te Te3 1 0.18907500 0.00253900 0.15717300 1.0 Te Te4 1 0.18329300 0.20358200 0.81918300 1.0 Te Te5 1 0.81670700 0.70358200 0.18081700 1.0 Te Te6 1 0.18329300 0.70358200 0.68081700 1.0 Te Te7 1 0.81670700 0.20358200 0.31918300 1.0 P P8 1 0.54755600 0.31147600 0.58703400 1.0 P P9 1 0.45244400 0.81147600 0.41296600 1.0 P P10 1 0.54755600 0.81147600 0.91296600 1.0 P P11 1 0.45244400 0.31147600 0.08703400 1.0 O O12 1 0.91033900 0.16894400 0.76615200 1.0 O O13 1 0.08966100 0.66894400 0.23384800 1.0 O O14 1 0.91033900 0.66894400 0.73384800 1.0 O O15 1 0.08966100 0.16894400 0.26615200 1.0 O O16 1 0.08453800 0.91735500 0.66101600 1.0 O O17 1 0.91546200 0.41735500 0.33898400 1.0 O O18 1 0.08453800 0.41735500 0.83898400 1.0 O O19 1 0.91546200 0.91735500 0.16101600 1.0 O O20 1 0.58571500 0.30421400 0.42988500 1.0 O O21 1 0.41428500 0.80421400 0.57011500 1.0 O O22 1 0.58571500 0.80421400 0.07011500 1.0 O O23 1 0.41428500 0.30421400 0.92988500 1.0 O O24 1 0.90519800 0.11978600 0.49287300 1.0 O O25 1 0.09480200 0.61978600 0.50712700 1.0 O O26 1 0.90519800 0.61978600 0.00712700 1.0 O O27 1 0.09480200 0.11978600 0.99287300 1.0 O O28 1 0.34800800 0.36243400 0.61243300 1.0 O O29 1 0.65199200 0.86243400 0.38756700 1.0 O O30 1 0.34800800 0.86243400 0.88756700 1.0 O O31 1 0.65199200 0.36243400 0.11243300 1.0 O O32 1 0.57170300 0.14019400 0.65270100 1.0 O O33 1 0.42829700 0.64019400 0.34729900 1.0 O O34 1 0.57170300 0.64019400 0.84729900 1.0 O O35 1 0.42829700 0.14019400 0.15270100 1.0 O O36 1 0.69477600 0.42868600 0.64746100 1.0 O O37 1 0.30522400 0.92868600 0.35253900 1.0 O O38 1 0.69477600 0.92868600 0.85253900 1.0 O O39 1 0.30522400 0.42868600 0.14746100 1.0