# generated using pymatgen data_Y8Cu3(SiS7)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 17.29832600 _cell_length_b 9.81804800 _cell_length_c 9.87130042 _cell_angle_alpha 60.20680405 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y8Cu3(SiS7)3 _chemical_formula_sum 'Y16 Cu6 Si6 S42' _cell_volume 1454.90784857 _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 Y Y0 1 0.74838400 0.23591000 0.64016100 1.0 Y Y1 1 0.42109900 0.23435400 0.64673200 1.0 Y Y2 1 0.08325000 0.23476500 0.63154200 1.0 Y Y3 1 0.92109900 0.76564600 0.35326800 1.0 Y Y4 1 0.58325000 0.76523500 0.36845800 1.0 Y Y5 1 0.24838400 0.76409000 0.35983900 1.0 Y Y6 1 0.75401300 0.64129400 0.12633400 1.0 Y Y7 1 0.41965900 0.63646600 0.13077800 1.0 Y Y8 1 0.91972000 0.86853600 0.77115400 1.0 Y Y9 1 0.58476500 0.86881800 0.76506000 1.0 Y Y10 1 0.24794900 0.86620300 0.77265800 1.0 Y Y11 1 0.91965900 0.36353400 0.86922200 1.0 Y Y12 1 0.25401300 0.35870600 0.87366600 1.0 Y Y13 1 0.74794900 0.13379700 0.22734200 1.0 Y Y14 1 0.41972000 0.13146400 0.22884600 1.0 Y Y15 1 0.08476500 0.13118200 0.23494000 1.0 Cu Cu16 1 0.76817800 0.99688400 0.99914800 1.0 Cu Cu17 1 0.43048100 0.99977000 0.00081300 1.0 Cu Cu18 1 0.09823900 0.98748100 0.00380700 1.0 Cu Cu19 1 0.93048100 0.00023000 0.99918700 1.0 Cu Cu20 1 0.59823900 0.01251900 0.99619300 1.0 Cu Cu21 1 0.26817800 0.00311600 0.00085200 1.0 Si Si22 1 0.72297700 0.66187600 0.67080100 1.0 Si Si23 1 0.39245400 0.67287700 0.66249300 1.0 Si Si24 1 0.05565800 0.66383200 0.66901500 1.0 Si Si25 1 0.89245400 0.32712300 0.33750700 1.0 Si Si26 1 0.55565800 0.33616800 0.33098500 1.0 Si Si27 1 0.22297700 0.33812400 0.32919900 1.0 S S28 1 0.75850400 0.90918600 0.83140800 1.0 S S29 1 0.42790000 0.90760800 0.83519400 1.0 S S30 1 0.09082200 0.91430300 0.82730000 1.0 S S31 1 0.83690100 0.10519000 0.47995000 1.0 S S32 1 0.50705400 0.10796800 0.47848700 1.0 S S33 1 0.17460800 0.10820500 0.47831200 1.0 S S34 1 0.67832300 0.33532900 0.33416800 1.0 S S35 1 0.34593700 0.33284700 0.33438700 1.0 S S36 1 0.01279300 0.32652200 0.33753800 1.0 S S37 1 0.91727900 0.74465900 0.08743000 1.0 S S38 1 0.59428000 0.75063900 0.08984200 1.0 S S39 1 0.26688400 0.74491800 0.09274800 1.0 S S40 1 0.84210900 0.41168800 0.10983900 1.0 S S41 1 0.50950900 0.41435400 0.10656300 1.0 S S42 1 0.17418600 0.41275700 0.10559700 1.0 S S43 1 0.67460800 0.89179500 0.52168800 1.0 S S44 1 0.33690100 0.89481000 0.52005000 1.0 S S45 1 0.00705400 0.89203200 0.52151300 1.0 S S46 1 0.67418600 0.58724300 0.89440300 1.0 S S47 1 0.34210900 0.58831200 0.89016100 1.0 S S48 1 0.00950900 0.58564600 0.89343700 1.0 S S49 1 0.76688400 0.25508200 0.90725200 1.0 S S50 1 0.41727900 0.25534100 0.91257000 1.0 S S51 1 0.09428000 0.24936100 0.91015800 1.0 S S52 1 0.75992800 0.83817600 0.25674000 1.0 S S53 1 0.42769800 0.83464100 0.25828500 1.0 S S54 1 0.09302000 0.84002900 0.25953100 1.0 S S55 1 0.84593700 0.66715300 0.66561300 1.0 S S56 1 0.51279300 0.67347800 0.66246200 1.0 S S57 1 0.17832300 0.66467100 0.66583200 1.0 S S58 1 0.67755300 0.52390600 0.57804400 1.0 S S59 1 0.34128100 0.52248200 0.58614600 1.0 S S60 1 0.00791300 0.51999100 0.58298700 1.0 S S61 1 0.92769800 0.16535900 0.74171500 1.0 S S62 1 0.59302000 0.15997100 0.74046900 1.0 S S63 1 0.25992800 0.16182400 0.74326000 1.0 S S64 1 0.84128100 0.47751800 0.41385400 1.0 S S65 1 0.50791300 0.48000900 0.41701300 1.0 S S66 1 0.17755300 0.47609400 0.42195600 1.0 S S67 1 0.92790000 0.09239200 0.16480600 1.0 S S68 1 0.59082200 0.08569700 0.17270000 1.0 S S69 1 0.25850400 0.09081400 0.16859200 1.0