# generated using pymatgen data_Sr4Si6NiHg _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.82133443 _cell_length_b 10.26873321 _cell_length_c 8.28549871 _cell_angle_alpha 78.35311633 _cell_angle_beta 58.29613831 _cell_angle_gamma 43.35073986 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr4Si6NiHg _chemical_formula_sum 'Sr8 Si12 Ni2 Hg2' _cell_volume 558.71821209 _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 Sr Sr0 1 0.13164217 0.11704333 0.87196426 1.0 Sr Sr1 1 0.87196526 0.87934924 0.13164117 1.0 Sr Sr2 1 0.13295767 0.11835883 0.37065076 1.0 Sr Sr3 1 0.37065176 0.37803574 0.13295667 1.0 Sr Sr4 1 0.61846464 0.63082830 0.37815477 1.0 Sr Sr5 1 0.37815477 0.37255229 0.61846464 1.0 Sr Sr6 1 0.61917270 0.63153536 0.87744771 1.0 Sr Sr7 1 0.87744871 0.87184623 0.61917170 1.0 Si Si8 1 0.90625955 0.59177556 0.43640358 1.0 Si Si9 1 0.09669414 0.39928048 0.57825484 1.0 Si Si10 1 0.43640358 0.06556131 0.90625955 1.0 Si Si11 1 0.57825484 0.92576954 0.09669414 1.0 Si Si12 1 0.32423046 0.67174516 0.85071952 1.0 Si Si13 1 0.65822444 0.34374045 0.18443869 1.0 Si Si14 1 0.85071952 0.15330586 0.32423046 1.0 Si Si15 1 0.18443869 0.81359642 0.65822444 1.0 Si Si16 1 0.90701041 0.59299059 0.90700941 1.0 Si Si17 1 0.57558763 0.92441337 0.57558663 1.0 Si Si18 1 0.32558763 0.67441337 0.32558763 1.0 Si Si19 1 0.65700941 0.34299059 0.65700941 1.0 Ni Ni20 1 0.16696818 0.83303182 0.16696818 1.0 Ni Ni21 1 0.41696818 0.08303182 0.41696818 1.0 Hg Hg22 1 0.08259283 0.41740717 0.08259283 1.0 Hg Hg23 1 0.83259283 0.16740717 0.83259283 1.0