# generated using pymatgen data_Zr10Hg6CO _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58158362 _cell_length_b 8.58158496 _cell_length_c 5.50887585 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000974 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10Hg6CO _chemical_formula_sum 'Zr10 Hg6 C1 O1' _cell_volume 351.34074624 _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 Zr Zr0 1 0.66666700 0.33333300 0.00000000 1.0 Zr Zr1 1 0.33333300 0.66666700 0.00000000 1.0 Zr Zr2 1 0.21815954 1.00000000 0.25430438 1.0 Zr Zr3 1 1.00000000 0.21815954 0.25430438 1.0 Zr Zr4 1 0.78184046 0.78184046 0.25430438 1.0 Zr Zr5 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr6 1 0.33333300 0.66666700 0.50000000 1.0 Zr Zr7 1 0.78184046 0.00000000 0.74569562 1.0 Zr Zr8 1 0.00000000 0.78184046 0.74569562 1.0 Zr Zr9 1 0.21815954 0.21815954 0.74569562 1.0 Hg Hg10 1 0.60036225 0.00000000 0.24810469 1.0 Hg Hg11 1 0.00000000 0.60036225 0.24810469 1.0 Hg Hg12 1 0.39963775 0.39963775 0.24810469 1.0 Hg Hg13 1 0.39963775 1.00000000 0.75189531 1.0 Hg Hg14 1 1.00000000 0.39963775 0.75189531 1.0 Hg Hg15 1 0.60036225 0.60036225 0.75189531 1.0 C C16 1 0.00000000 0.00000000 0.50000000 1.0 O O17 1 0.00000000 0.00000000 0.00000000 1.0