# generated using pymatgen data_Ho4CCl6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.73742404 _cell_length_b 12.28017403 _cell_length_c 12.79040890 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4CCl6 _chemical_formula_sum 'Ho8 C2 Cl12' _cell_volume 587.03139001 _cell_formula_units_Z 2 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 Ho Ho0 1 0.00000000 0.10453557 0.08014802 1.0 Ho Ho1 1 0.00000000 0.89546443 0.91985198 1.0 Ho Ho2 1 0.00000000 0.60453557 0.41985198 1.0 Ho Ho3 1 0.00000000 0.39546443 0.58014802 1.0 Ho Ho4 1 0.50000000 0.12295251 0.85213124 1.0 Ho Ho5 1 0.50000000 0.87704749 0.14786876 1.0 Ho Ho6 1 0.50000000 0.62295251 0.64786876 1.0 Ho Ho7 1 0.50000000 0.37704749 0.35213124 1.0 C C8 1 0.50000000 0.00000000 0.00000000 1.0 C C9 1 0.50000000 0.50000000 0.50000000 1.0 Cl Cl10 1 0.50000000 0.26426282 0.67947690 1.0 Cl Cl11 1 0.50000000 0.73573718 0.32052310 1.0 Cl Cl12 1 0.50000000 0.76426282 0.82052310 1.0 Cl Cl13 1 0.50000000 0.23573718 0.17947690 1.0 Cl Cl14 1 0.00000000 0.25930716 0.92740623 1.0 Cl Cl15 1 0.00000000 0.74069284 0.07259377 1.0 Cl Cl16 1 0.00000000 0.48375719 0.24126101 1.0 Cl Cl17 1 0.00000000 0.51624281 0.75873899 1.0 Cl Cl18 1 0.00000000 0.98375719 0.25873899 1.0 Cl Cl19 1 0.00000000 0.01624281 0.74126101 1.0 Cl Cl20 1 0.00000000 0.24069284 0.42740623 1.0 Cl Cl21 1 0.00000000 0.75930716 0.57259377 1.0