# generated using pymatgen data_HgPO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.44550000 _cell_length_b 7.28638436 _cell_length_c 7.38362350 _cell_angle_alpha 80.79344230 _cell_angle_beta 81.79898351 _cell_angle_gamma 84.34176996 _symmetry_Int_Tables_number 1 _chemical_formula_structural HgPO4 _chemical_formula_sum 'Hg4 P4 O16' _cell_volume 337.77943656 _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 Hg Hg0 1 0.12234700 0.28546300 0.19197300 1.0 Hg Hg1 1 0.87765300 0.71453700 0.80802700 1.0 Hg Hg2 1 0.44891300 0.82568200 0.23642100 1.0 Hg Hg3 1 0.55108700 0.17431800 0.76357900 1.0 P P4 1 0.61053000 0.30866500 0.25621400 1.0 P P5 1 0.38947000 0.69133500 0.74378600 1.0 P P6 1 0.94534500 0.78442800 0.29611100 1.0 P P7 1 0.05465500 0.21557200 0.70388900 1.0 O O8 1 0.46207100 0.21650600 0.14928600 1.0 O O9 1 0.53792900 0.78349400 0.85071400 1.0 O O10 1 0.81143200 0.34408000 0.11451100 1.0 O O11 1 0.18856800 0.65592000 0.88548900 1.0 O O12 1 0.49727100 0.48970500 0.31647800 1.0 O O13 1 0.50272900 0.51029500 0.68352200 1.0 O O14 1 0.66403900 0.18245700 0.43370700 1.0 O O15 1 0.33596100 0.81754300 0.56629300 1.0 O O16 1 0.12510100 0.91459200 0.20787400 1.0 O O17 1 0.87489900 0.08540800 0.79212600 1.0 O O18 1 0.78218600 0.81938000 0.15296200 1.0 O O19 1 0.21781400 0.18062000 0.84703800 1.0 O O20 1 0.03621400 0.57989600 0.32731400 1.0 O O21 1 0.96378600 0.42010400 0.67268600 1.0 O O22 1 0.83824600 0.83101100 0.48394700 1.0 O O23 1 0.16175400 0.16898900 0.51605300 1.0