# generated using pymatgen data_YCu3(WO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99314600 _cell_length_b 9.52559700 _cell_length_c 17.49995646 _cell_angle_alpha 60.29693606 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YCu3(WO4)6 _chemical_formula_sum 'Y2 Cu6 W12 O48' _cell_volume 867.77346065 _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 0.33998800 0.50000000 0.25000000 1.0 Y Y1 1 0.66001200 0.50000000 0.75000000 1.0 Cu Cu2 1 0.70711300 0.33329400 0.41474200 1.0 Cu Cu3 1 0.70711300 0.66670600 0.08525800 1.0 Cu Cu4 1 0.69497400 0.00000000 0.75000000 1.0 Cu Cu5 1 0.29288700 0.66670600 0.58525800 1.0 Cu Cu6 1 0.30502600 0.00000000 0.25000000 1.0 Cu Cu7 1 0.29288700 0.33329400 0.91474200 1.0 W W8 1 0.82575200 0.91770400 0.58397000 1.0 W W9 1 0.82566700 0.23476500 0.25244700 1.0 W W10 1 0.83363200 0.57887800 0.92350000 1.0 W W11 1 0.83363200 0.42112200 0.57650000 1.0 W W12 1 0.82566700 0.76523500 0.24755300 1.0 W W13 1 0.82575200 0.08229600 0.91603000 1.0 W W14 1 0.17424800 0.08229600 0.41603000 1.0 W W15 1 0.16636800 0.42112200 0.07650000 1.0 W W16 1 0.17433300 0.76523500 0.74755300 1.0 W W17 1 0.16636800 0.57887800 0.42350000 1.0 W W18 1 0.17424800 0.91770400 0.08397000 1.0 W W19 1 0.17433300 0.23476500 0.75244700 1.0 O O20 1 0.67286100 0.33525800 0.51923100 1.0 O O21 1 0.65828200 0.66594100 0.19225300 1.0 O O22 1 0.66542900 0.00407400 0.85430500 1.0 O O23 1 0.66542900 0.99592600 0.64569500 1.0 O O24 1 0.65828200 0.33405900 0.30774700 1.0 O O25 1 0.67286100 0.66474200 0.98076900 1.0 O O26 1 0.32713900 0.66474200 0.48076900 1.0 O O27 1 0.33457100 0.99592600 0.14569500 1.0 O O28 1 0.34171800 0.33405900 0.80774700 1.0 O O29 1 0.33457100 0.00407400 0.35430500 1.0 O O30 1 0.32713900 0.33525800 0.01923100 1.0 O O31 1 0.34171800 0.66594100 0.69225300 1.0 O O32 1 0.09934900 0.87397200 0.52377700 1.0 O O33 1 0.09494000 0.20700200 0.18830500 1.0 O O34 1 0.09492200 0.54041000 0.85442800 1.0 O O35 1 0.09492200 0.45959000 0.64557200 1.0 O O36 1 0.09494000 0.79299800 0.31169500 1.0 O O37 1 0.09934900 0.12602800 0.97622300 1.0 O O38 1 0.90065100 0.12602800 0.47622300 1.0 O O39 1 0.90507800 0.45959000 0.14557200 1.0 O O40 1 0.90506000 0.79299800 0.81169500 1.0 O O41 1 0.90507800 0.54041000 0.35442800 1.0 O O42 1 0.90065100 0.87397200 0.02377700 1.0 O O43 1 0.90506000 0.20700200 0.68830500 1.0 O O44 1 0.38614200 0.51840600 0.37180700 1.0 O O45 1 0.39730300 0.84552900 0.04595800 1.0 O O46 1 0.40142600 0.17952200 0.70799300 1.0 O O47 1 0.39730300 0.15447100 0.45404200 1.0 O O48 1 0.38614200 0.48159400 0.12819300 1.0 O O49 1 0.40142600 0.82047800 0.79200700 1.0 O O50 1 0.61385800 0.48159400 0.62819300 1.0 O O51 1 0.59857400 0.82047800 0.29200700 1.0 O O52 1 0.60269700 0.15447100 0.95404200 1.0 O O53 1 0.60269700 0.84552900 0.54595800 1.0 O O54 1 0.59857400 0.17952200 0.20799300 1.0 O O55 1 0.61385800 0.51840600 0.87180700 1.0 O O56 1 0.11057200 0.37408400 0.51871000 1.0 O O57 1 0.10690800 0.70613900 0.18398700 1.0 O O58 1 0.10793700 0.04047800 0.85046000 1.0 O O59 1 0.88942800 0.62591600 0.48129000 1.0 O O60 1 0.89206300 0.95952200 0.14954000 1.0 O O61 1 0.89309200 0.29386100 0.81601300 1.0 O O62 1 0.10793700 0.95952200 0.64954000 1.0 O O63 1 0.10690800 0.29386100 0.31601300 1.0 O O64 1 0.11057200 0.62591600 0.98129000 1.0 O O65 1 0.89206300 0.04047800 0.35046000 1.0 O O66 1 0.88942800 0.37408400 0.01871000 1.0 O O67 1 0.89309200 0.70613900 0.68398700 1.0