# generated using pymatgen data_Ba5Y2CuMo2O15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.02078090 _cell_length_b 8.47666100 _cell_length_c 15.89632772 _cell_angle_alpha 74.53657318 _cell_angle_beta 79.08360199 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba5Y2CuMo2O15 _chemical_formula_sum 'Ba10 Y4 Cu2 Mo4 O30' _cell_volume 766.67622543 _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 Ba Ba0 1 0.70259900 0.44799400 0.59480200 1.0 Ba Ba1 1 0.10079800 0.84987400 0.79840300 1.0 Ba Ba2 1 0.50000000 0.26100800 0.00000000 1.0 Ba Ba3 1 0.89920200 0.64827800 0.20159700 1.0 Ba Ba4 1 0.29740100 0.04279600 0.40519800 1.0 Ba Ba5 1 0.70259900 0.95720400 0.59480200 1.0 Ba Ba6 1 0.10079800 0.35172200 0.79840300 1.0 Ba Ba7 1 0.50000000 0.73899200 0.00000000 1.0 Ba Ba8 1 0.89920200 0.15012600 0.20159700 1.0 Ba Ba9 1 0.29740100 0.55200600 0.40519800 1.0 Y Y10 1 0.00000000 0.50000000 0.00000000 1.0 Y Y11 1 0.00000000 0.00000000 0.00000000 1.0 Y Y12 1 0.39744800 0.39744800 0.20510400 1.0 Y Y13 1 0.60255200 0.60255200 0.79489600 1.0 Cu Cu14 1 0.80028900 0.80028900 0.39942100 1.0 Cu Cu15 1 0.19971100 0.19971100 0.60057900 1.0 Mo Mo16 1 0.39743100 0.89743100 0.20513900 1.0 Mo Mo17 1 0.79746600 0.29746600 0.40506800 1.0 Mo Mo18 1 0.20253400 0.70253400 0.59493200 1.0 Mo Mo19 1 0.60256900 0.10256900 0.79486100 1.0 O O20 1 0.20105100 0.46699900 0.59789900 1.0 O O21 1 0.60261200 0.87255300 0.79477700 1.0 O O22 1 0.00000000 0.24570000 0.00000000 1.0 O O23 1 0.39738800 0.66733000 0.20522300 1.0 O O24 1 0.79894900 0.06489700 0.40210100 1.0 O O25 1 0.38490700 0.65659300 0.68681400 1.0 O O26 1 0.78323000 0.05505400 0.88989100 1.0 O O27 1 0.19873000 0.44692600 0.10614800 1.0 O O28 1 0.58599400 0.85265300 0.29469500 1.0 O O29 1 0.98477700 0.25205800 0.49588400 1.0 O O30 1 0.48066100 0.74794200 0.50411600 1.0 O O31 1 0.88068800 0.14734700 0.70530500 1.0 O O32 1 0.30487800 0.55307400 0.89385200 1.0 O O33 1 0.67312100 0.94494600 0.11010900 1.0 O O34 1 0.07172100 0.34340700 0.31318600 1.0 O O35 1 0.20105100 0.93510300 0.59789900 1.0 O O36 1 0.60261200 0.33267000 0.79477700 1.0 O O37 1 0.00000000 0.75430000 0.00000000 1.0 O O38 1 0.39738800 0.12744700 0.20522300 1.0 O O39 1 0.79894900 0.53300100 0.40210100 1.0 O O40 1 0.01522300 0.74794200 0.50411600 1.0 O O41 1 0.41400600 0.14734700 0.70530500 1.0 O O42 1 0.80127000 0.55307400 0.89385200 1.0 O O43 1 0.21677000 0.94494600 0.11010900 1.0 O O44 1 0.61509300 0.34340700 0.31318600 1.0 O O45 1 0.92827900 0.65659300 0.68681400 1.0 O O46 1 0.32687900 0.05505400 0.88989100 1.0 O O47 1 0.69512200 0.44692600 0.10614800 1.0 O O48 1 0.11931200 0.85265300 0.29469500 1.0 O O49 1 0.51933900 0.25205800 0.49588400 1.0