# generated using pymatgen data_Sc2Hg2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.37378583 _cell_length_b 3.37378730 _cell_length_c 9.69749703 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999527 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Hg2C _chemical_formula_sum 'Sc2 Hg2 C1' _cell_volume 95.59287359 _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 Sc Sc0 1 0.33333300 0.66666600 0.37526577 1.0 Sc Sc1 1 0.66666500 0.33333300 0.62473523 1.0 Hg Hg2 1 0.66666500 0.33333300 0.13112842 1.0 Hg Hg3 1 0.33333300 0.66666600 0.86887158 1.0 C C4 1 0.00000000 0.00000000 0.50000000 1.0