# generated using pymatgen data_Sr14Hg51 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.17250084 _cell_length_b 14.17250084 _cell_length_c 10.37258000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000390 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr14Hg51 _chemical_formula_sum 'Sr14 Hg51' _cell_volume 1804.30681810 _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 Sr Sr0 1 0.79840100 0.99228400 0.50000000 1.0 Sr Sr1 1 0.19388300 0.20159900 0.50000000 1.0 Sr Sr2 1 0.00771600 0.80611700 0.50000000 1.0 Sr Sr3 1 0.86564400 0.34026600 0.50000000 1.0 Sr Sr4 1 0.47462200 0.13435600 0.50000000 1.0 Sr Sr5 1 0.65973400 0.52537800 0.50000000 1.0 Sr Sr6 1 0.44835000 0.39293400 0.00000000 1.0 Sr Sr7 1 0.94458400 0.55165000 0.00000000 1.0 Sr Sr8 1 0.60706600 0.05541600 0.00000000 1.0 Sr Sr9 1 0.21674600 0.94796000 0.00000000 1.0 Sr Sr10 1 0.73121400 0.78325400 0.00000000 1.0 Sr Sr11 1 0.05204000 0.26878600 0.00000000 1.0 Sr Sr12 1 0.33333300 0.66666700 0.69164300 1.0 Sr Sr13 1 0.33333300 0.66666700 0.30835700 1.0 Hg Hg14 1 0.82588900 0.04571400 0.85273500 1.0 Hg Hg15 1 0.21982500 0.17411100 0.85273500 1.0 Hg Hg16 1 0.95428600 0.78017500 0.85273500 1.0 Hg Hg17 1 0.83882500 0.28637900 0.85334800 1.0 Hg Hg18 1 0.44755500 0.16117500 0.85334800 1.0 Hg Hg19 1 0.71362100 0.55244500 0.85334800 1.0 Hg Hg20 1 0.83882500 0.28637900 0.14665200 1.0 Hg Hg21 1 0.44755500 0.16117500 0.14665200 1.0 Hg Hg22 1 0.71362100 0.55244500 0.14665200 1.0 Hg Hg23 1 0.82588900 0.04571400 0.14726500 1.0 Hg Hg24 1 0.21982500 0.17411100 0.14726500 1.0 Hg Hg25 1 0.95428600 0.78017500 0.14726500 1.0 Hg Hg26 1 0.38957700 0.48761900 0.50000000 1.0 Hg Hg27 1 0.09804200 0.61042300 0.50000000 1.0 Hg Hg28 1 0.51238100 0.90195800 0.50000000 1.0 Hg Hg29 1 0.27685900 0.84333900 0.50000000 1.0 Hg Hg30 1 0.56648000 0.72314100 0.50000000 1.0 Hg Hg31 1 0.15666100 0.43352000 0.50000000 1.0 Hg Hg32 1 0.00000000 0.00000000 0.00000000 1.0 Hg Hg33 1 0.66666700 0.33333300 0.00000000 1.0 Hg Hg34 1 0.43860800 0.32804000 0.66412400 1.0 Hg Hg35 1 0.88943100 0.56139200 0.66412400 1.0 Hg Hg36 1 0.67196000 0.11056900 0.66412400 1.0 Hg Hg37 1 0.22641700 0.00262000 0.66380800 1.0 Hg Hg38 1 0.77620400 0.77358300 0.66380800 1.0 Hg Hg39 1 0.99738000 0.22379600 0.66380800 1.0 Hg Hg40 1 0.22641700 0.00262000 0.33619200 1.0 Hg Hg41 1 0.77620400 0.77358300 0.33619200 1.0 Hg Hg42 1 0.99738000 0.22379600 0.33619200 1.0 Hg Hg43 1 0.43860800 0.32804000 0.33587600 1.0 Hg Hg44 1 0.88943100 0.56139200 0.33587600 1.0 Hg Hg45 1 0.67196000 0.11056900 0.33587600 1.0 Hg Hg46 1 0.52732000 0.58965800 0.77118900 1.0 Hg Hg47 1 0.06233800 0.47268000 0.77118900 1.0 Hg Hg48 1 0.41034200 0.93766200 0.77118900 1.0 Hg Hg49 1 0.14150400 0.74119000 0.77609600 1.0 Hg Hg50 1 0.59968600 0.85849600 0.77609600 1.0 Hg Hg51 1 0.25881000 0.40031400 0.77609600 1.0 Hg Hg52 1 0.14150400 0.74119000 0.22390400 1.0 Hg Hg53 1 0.59968600 0.85849600 0.22390400 1.0 Hg Hg54 1 0.25881000 0.40031400 0.22390400 1.0 Hg Hg55 1 0.52732000 0.58965800 0.22881100 1.0 Hg Hg56 1 0.06233800 0.47268000 0.22881100 1.0 Hg Hg57 1 0.41034200 0.93766200 0.22881100 1.0 Hg Hg58 1 0.00000000 0.00000000 0.68802100 1.0 Hg Hg59 1 0.66666700 0.33333300 0.69232600 1.0 Hg Hg60 1 0.66666700 0.33333300 0.30767400 1.0 Hg Hg61 1 0.00000000 0.00000000 0.31197900 1.0 Hg Hg62 1 0.46189200 0.68350900 0.00000000 1.0 Hg Hg63 1 0.22161800 0.53810800 0.00000000 1.0 Hg Hg64 1 0.31649100 0.77838200 0.00000000 1.0