data_image0 _chemical_formula_structural HgTe18W9 _chemical_formula_sum "Hg1 Te18 W9" _cell_length_a 10.65022866621408 _cell_length_b 10.65022866621408 _cell_length_c 18.62392442646693 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 120.00000000000001 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz '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 Hg Hg1 1.0 0.22340588543730902 0.1116983490906222 0.8006303859420829 1.0000 Te Te1 1.0 0.8891464505742275 0.7784620282617973 0.5955368676776138 1.0000 Te Te2 1.0 0.889091273626775 0.44455488863335924 0.4032890129406758 1.0000 Te Te3 1.0 0.8891558094097071 0.4445855855930362 0.5931476712646351 1.0000 Te Te4 1.0 0.8883657103427979 0.1115384656096828 0.3999814569741539 1.0000 Te Te5 1.0 0.889174343172696 0.11070118487609461 0.5955325653778049 1.0000 Te Te6 1.0 0.5560176677075916 0.7780118498406445 0.4034083529416518 1.0000 Te Te7 1.0 0.5551747862886401 0.777589881863031 0.5931029792707321 1.0000 Te Te8 1.0 0.5558230660652709 0.44445718714948784 0.4000329935872283 1.0000 Te Te9 1.0 0.8883500898303192 0.776805299223888 0.3999801438522994 1.0000 Te Te10 1.0 0.5558567011255836 0.1113853361516985 0.40002981485852174 1.0000 Te Te11 1.0 0.5550276079846261 0.44401893045129076 0.5957506704147061 1.0000 Te Te12 1.0 0.22196574129815982 0.7771088478448362 0.40010046930615945 1.0000 Te Te13 1.0 0.22276844225733272 0.7785611599323725 0.5956748526794218 1.0000 Te Te14 1.0 0.22194115922027194 0.44484619045879403 0.4001112189644713 1.0000 Te Te15 1.0 0.22277483996710762 0.4441946567746829 0.5956812716131201 1.0000 Te Te16 1.0 0.22141367804604833 0.110705556516068 0.40211305366849587 1.0000 Te Te17 1.0 0.22218542746609582 0.11107924339405281 0.5919917144219656 1.0000 Te Te18 1.0 0.5550196583866818 0.1110206299783155 0.5957658117456507 1.0000 W W1 1.0 0.33560270055848196 0.3380052865320965 0.4973498434515557 1.0000 W W2 1.0 0.33561890045559667 0.9976018821369401 0.49735304511345324 1.0000 W W3 1.0 0.3285835525194583 0.6642994529442215 0.4980827486222116 1.0000 W W4 1.0 0.0025444910796363737 0.6716674800318977 0.49807723085280453 1.0000 W W5 1.0 0.669051865954066 0.0050280928901268 0.49804597301283976 1.0000 W W6 1.0 0.6618145116774959 0.33090491259446003 0.49806192427875984 1.0000 W W7 1.0 0.0025322157405389045 0.3308749494851815 0.4980837325952669 1.0000 W W8 1.0 0.6690482266198544 0.6640288865881745 0.4980432729508765 1.0000 W W9 1.0 0.9947674194098337 0.9973748962642748 0.49730791701421995 1.0000