data_image0 _chemical_formula_structural ZrMoZrMoS8 _chemical_formula_sum "Zr2 Mo2 S8" _cell_length_a 6.8926200083641165 _cell_length_b 6.8674362155927335 _cell_length_c 33.19 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 119.90045079130459 _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 Zr Zr1 1.0 0.5000000000000007 8.881784197001252e-16 0.5 1.0000 Mo Mo1 1.0 0.9999999999999998 0.999999999999999 0.5 1.0000 Zr Zr2 1.0 0.4999999999999999 0.4999999999999995 0.5 1.0000 Mo Mo2 1.0 4.440892098500626e-16 0.5000000000000003 0.5 1.0000 S S1 1.0 0.32156792231949627 0.16078434236636815 0.5463593456030498 1.0000 S S2 1.0 0.8462010539401569 0.1731020473618799 0.5451522171430428 1.0000 S S3 1.0 0.32156792170737275 0.6607843416209753 0.5463593456795536 1.0000 S S4 1.0 0.8462010543599534 0.6731020479190511 0.5451522171388579 1.0000 S S5 1.0 0.15379894564004615 0.3268979520809487 0.4548477828611418 1.0000 S S6 1.0 0.6784320782926276 0.3392156583790245 0.4536406543204468 1.0000 S S7 1.0 0.1537989460598437 0.8268979526381204 0.4548477828569573 1.0000 S S8 1.0 0.678432077680504 0.8392156576336314 0.45364065439695017 1.0000