# generated using pymatgen data_Ac6HgOsI6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.67792305 _cell_length_b 11.67792318 _cell_length_c 11.41235172 _cell_angle_alpha 109.29315713 _cell_angle_beta 109.29316044 _cell_angle_gamma 110.74588984 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ac6HgOsI6 _chemical_formula_sum 'Ac12 Hg2 Os2 I12' _cell_volume 1184.10981743 _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 Ac Ac0 1 0.46349559 0.49210508 0.22398425 1.0 Ac Ac1 1 0.76812083 0.23951234 0.27601575 1.0 Ac Ac2 1 0.77409800 0.03375557 0.49309596 1.0 Ac Ac3 1 0.21899796 0.45933940 0.49309596 1.0 Ac Ac4 1 0.26048766 0.73187917 0.22398425 1.0 Ac Ac5 1 0.04066060 0.28100204 0.00690404 1.0 Ac Ac6 1 0.00789492 0.03650441 0.27601575 1.0 Ac Ac7 1 0.46624443 0.72590200 0.00690404 1.0 Ac Ac8 1 0.48687914 0.23687914 0.47375728 1.0 Ac Ac9 1 0.01982015 0.48017985 0.75000000 1.0 Ac Ac10 1 0.26312086 0.01312086 0.02624272 1.0 Ac Ac11 1 0.23017985 0.26982015 0.75000000 1.0 Hg Hg12 1 0.24883906 0.25116094 0.25000000 1.0 Hg Hg13 1 0.50116094 0.99883906 0.25000000 1.0 Os Os14 1 0.00172644 0.25172644 0.50345189 1.0 Os Os15 1 0.24827356 0.49827356 0.99654811 1.0 I I16 1 0.25177167 0.76340465 0.74217380 1.0 I I17 1 0.52123085 0.50959787 0.75782620 1.0 I I18 1 0.98536344 0.74421475 0.99510662 1.0 I I19 1 0.73659535 0.24822833 0.75782620 1.0 I I20 1 0.99040213 0.97876915 0.74217380 1.0 I I21 1 0.24911013 0.99025782 0.50489338 1.0 I I22 1 0.75578525 0.51463656 0.50489338 1.0 I I23 1 0.50974218 0.25088987 0.99510662 1.0 I I24 1 0.75953892 0.74046108 0.25000000 1.0 I I25 1 0.74198750 0.99198750 0.98397600 1.0 I I26 1 0.99046108 0.50953892 0.25000000 1.0 I I27 1 0.50801250 0.75801250 0.51602400 1.0