# generated using pymatgen data_Co8Cu7(MoO4)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.65720400 _cell_length_b 5.13973400 _cell_length_c 18.02554210 _cell_angle_alpha 89.61350932 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co8Cu7(MoO4)12 _chemical_formula_sum 'Co8 Cu7 Mo12 O48' _cell_volume 987.33009756 _cell_formula_units_Z 1 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 Co Co0 1 0.82583800 0.24497800 0.02749600 1.0 Co Co1 1 0.17512100 0.75051400 0.47312600 1.0 Co Co2 1 0.32265900 0.75286400 0.97130400 1.0 Co Co3 1 0.67759900 0.25076600 0.52853400 1.0 Co Co4 1 0.67734100 0.75286400 0.97130400 1.0 Co Co5 1 0.32240100 0.25076600 0.52853400 1.0 Co Co6 1 0.17416200 0.24497800 0.02749600 1.0 Co Co7 1 0.82487900 0.75051400 0.47312600 1.0 Cu Cu8 1 0.00000000 0.21734100 0.18294500 1.0 Cu Cu9 1 0.00000000 0.71579700 0.31723400 1.0 Cu Cu10 1 0.50000000 0.78778600 0.81773800 1.0 Cu Cu11 1 0.50000000 0.28373700 0.68158900 1.0 Cu Cu12 1 0.00000000 0.60678300 0.75108800 1.0 Cu Cu13 1 0.50000000 0.88827700 0.25250200 1.0 Cu Cu14 1 0.50000000 0.38775400 0.24746800 1.0 Mo Mo15 1 0.77820300 0.72271600 0.15548900 1.0 Mo Mo16 1 0.22154900 0.22286600 0.34480900 1.0 Mo Mo17 1 0.27795100 0.28084400 0.84294800 1.0 Mo Mo18 1 0.72090400 0.77388500 0.65619500 1.0 Mo Mo19 1 0.72204900 0.28084400 0.84294800 1.0 Mo Mo20 1 0.27909600 0.77388500 0.65619500 1.0 Mo Mo21 1 0.22179700 0.72271600 0.15548900 1.0 Mo Mo22 1 0.77845100 0.22286600 0.34480900 1.0 Mo Mo23 1 0.00000000 0.77750900 0.94564200 1.0 Mo Mo24 1 0.00000000 0.27640800 0.55525600 1.0 Mo Mo25 1 0.50000000 0.22196900 0.05405000 1.0 Mo Mo26 1 0.50000000 0.72416900 0.44578900 1.0 O O27 1 0.13767800 0.83565500 0.70228100 1.0 O O28 1 0.86029000 0.37591300 0.79781700 1.0 O O29 1 0.63604200 0.14657900 0.29688600 1.0 O O30 1 0.36405100 0.64557800 0.20386000 1.0 O O31 1 0.36395800 0.14657900 0.29688600 1.0 O O32 1 0.63594900 0.64557800 0.20386000 1.0 O O33 1 0.86232200 0.83565500 0.70228100 1.0 O O34 1 0.13971000 0.37591300 0.79781700 1.0 O O35 1 0.36598600 0.07004200 0.62615900 1.0 O O36 1 0.63199400 0.56730200 0.87472600 1.0 O O37 1 0.86638200 0.93042100 0.37449800 1.0 O O38 1 0.13374700 0.43381600 0.12557000 1.0 O O39 1 0.13361800 0.93042100 0.37449800 1.0 O O40 1 0.86625300 0.43381600 0.12557000 1.0 O O41 1 0.63401400 0.07004200 0.62615900 1.0 O O42 1 0.36800600 0.56730200 0.87472600 1.0 O O43 1 0.00000000 0.55917600 0.49134800 1.0 O O44 1 0.00000000 0.06655100 0.00710900 1.0 O O45 1 0.50000000 0.43787600 0.50769200 1.0 O O46 1 0.50000000 0.93627300 0.99230700 1.0 O O47 1 0.00000000 0.37118000 0.64705900 1.0 O O48 1 0.00000000 0.85363900 0.85183400 1.0 O O49 1 0.50000000 0.64205400 0.35092100 1.0 O O50 1 0.50000000 0.13986500 0.14932700 1.0 O O51 1 0.25879600 0.41865200 0.42767200 1.0 O O52 1 0.73954700 0.91976400 0.07228800 1.0 O O53 1 0.75791600 0.58190800 0.57201300 1.0 O O54 1 0.23930200 0.08361900 0.92684900 1.0 O O55 1 0.24208400 0.58190800 0.57201300 1.0 O O56 1 0.76069800 0.08361900 0.92684900 1.0 O O57 1 0.74120400 0.41865200 0.42767200 1.0 O O58 1 0.26045300 0.91976400 0.07228800 1.0 O O59 1 0.37337600 0.55999200 0.71192200 1.0 O O60 1 0.62988300 0.06211300 0.78773800 1.0 O O61 1 0.87275400 0.43425200 0.28867100 1.0 O O62 1 0.12756400 0.93338600 0.21084700 1.0 O O63 1 0.12724600 0.43425200 0.28867100 1.0 O O64 1 0.87243600 0.93338600 0.21084700 1.0 O O65 1 0.62662400 0.55999200 0.71192200 1.0 O O66 1 0.37011700 0.06211300 0.78773800 1.0 O O67 1 0.13827700 0.07608900 0.53637700 1.0 O O68 1 0.86190300 0.57835900 0.96547400 1.0 O O69 1 0.63743200 0.92420500 0.46412200 1.0 O O70 1 0.36272600 0.42211600 0.03584000 1.0 O O71 1 0.36256800 0.92420500 0.46412200 1.0 O O72 1 0.63727400 0.42211600 0.03584000 1.0 O O73 1 0.86172300 0.07608900 0.53637700 1.0 O O74 1 0.13809700 0.57835900 0.96547400 1.0