# generated using pymatgen data_Sb2MoSe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.61983452 _cell_length_b 6.61792123 _cell_length_c 18.59325558 _cell_angle_alpha 86.11407027 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sb2MoSe _chemical_formula_sum 'Sb16 Mo8 Se8' _cell_volume 812.68931933 _cell_formula_units_Z 8 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 Sb Sb0 1 0.40556762 0.19796010 0.27521415 1.0 Sb Sb1 1 0.90556762 0.80203990 0.22478585 1.0 Sb Sb2 1 0.59443238 0.80203990 0.72478585 1.0 Sb Sb3 1 0.09443238 0.19796010 0.77521415 1.0 Sb Sb4 1 0.84512813 0.19889682 0.27479244 1.0 Sb Sb5 1 0.34512813 0.80110318 0.22520756 1.0 Sb Sb6 1 0.15487187 0.80110318 0.72520756 1.0 Sb Sb7 1 0.65487187 0.19889682 0.77479244 1.0 Sb Sb8 1 0.37569295 0.07417641 0.42678910 1.0 Sb Sb9 1 0.87569295 0.92582359 0.07321090 1.0 Sb Sb10 1 0.62430705 0.92582359 0.57321090 1.0 Sb Sb11 1 0.12430705 0.07417641 0.92678910 1.0 Sb Sb12 1 0.87524366 0.07463267 0.42638169 1.0 Sb Sb13 1 0.37524366 0.92536733 0.07361831 1.0 Sb Sb14 1 0.12475634 0.92536733 0.57361831 1.0 Sb Sb15 1 0.62475634 0.07463267 0.92638169 1.0 Mo Mo16 1 0.87583121 0.67205674 0.49483963 1.0 Mo Mo17 1 0.37583121 0.32794326 0.00516037 1.0 Mo Mo18 1 0.12416879 0.32794326 0.50516037 1.0 Mo Mo19 1 0.62416879 0.67205674 0.99483963 1.0 Mo Mo20 1 0.62554692 0.32774330 0.50536130 1.0 Mo Mo21 1 0.12554692 0.67225670 0.99463870 1.0 Mo Mo22 1 0.37445308 0.67225670 0.49463870 1.0 Mo Mo23 1 0.87445308 0.32774330 0.00536130 1.0 Se Se24 1 0.87518177 0.41133337 0.59943619 1.0 Se Se25 1 0.37518177 0.58866663 0.90056381 1.0 Se Se26 1 0.12481823 0.58866663 0.40056381 1.0 Se Se27 1 0.62481823 0.41133337 0.09943619 1.0 Se Se28 1 0.62523305 0.58922098 0.40079577 1.0 Se Se29 1 0.12523305 0.41077902 0.09920423 1.0 Se Se30 1 0.37476695 0.41077902 0.59920423 1.0 Se Se31 1 0.87476695 0.58922098 0.90079577 1.0