# generated using pymatgen data_Mn3Cu(PO4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.00918700 _cell_length_b 4.90491400 _cell_length_c 9.82965348 _cell_angle_alpha 89.21079258 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3Cu(PO4)4 _chemical_formula_sum 'Mn3 Cu1 P4 O16' _cell_volume 289.69708378 _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 Mn Mn0 1 0.00000000 0.43525800 0.78554200 1.0 Mn Mn1 1 0.50000000 0.55822100 0.21406300 1.0 Mn Mn2 1 0.50000000 0.93389900 0.71683400 1.0 Cu Cu3 1 0.00000000 0.09324300 0.28997500 1.0 P P4 1 0.50000000 0.07988800 0.39935200 1.0 P P5 1 0.50000000 0.41234600 0.90150600 1.0 P P6 1 0.00000000 0.57936800 0.10104500 1.0 P P7 1 0.00000000 0.92319700 0.59929400 1.0 O O8 1 0.50000000 0.14529400 0.55177500 1.0 O O9 1 0.30217900 0.23250000 0.32667600 1.0 O O10 1 0.69782100 0.23250000 0.32667600 1.0 O O11 1 0.00000000 0.23309500 0.62011400 1.0 O O12 1 0.00000000 0.26417400 0.11805000 1.0 O O13 1 0.29989100 0.27197500 0.82921800 1.0 O O14 1 0.70010900 0.27197500 0.82921800 1.0 O O15 1 0.50000000 0.34164200 0.05420300 1.0 O O16 1 0.00000000 0.64554500 0.94701100 1.0 O O17 1 0.79684800 0.71568100 0.16994300 1.0 O O18 1 0.20315200 0.71568100 0.16994300 1.0 O O19 1 0.50000000 0.72469200 0.88327800 1.0 O O20 1 0.50000000 0.77192400 0.37837400 1.0 O O21 1 0.80077700 0.77481400 0.67126000 1.0 O O22 1 0.19922300 0.77481400 0.67126000 1.0 O O23 1 0.00000000 0.86827800 0.44538900 1.0