# generated using pymatgen data_Mn2Cu(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.55713375 _cell_length_b 8.55713375 _cell_length_c 8.55713315 _cell_angle_alpha 59.81676821 _cell_angle_beta 59.81676821 _cell_angle_gamma 59.81677257 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2Cu(PO4)3 _chemical_formula_sum 'Mn4 Cu2 P6 O24' _cell_volume 441.22479725 _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 Mn Mn0 1 0.14243900 0.14243900 0.14243900 1.0 Mn Mn1 1 0.35756100 0.35756100 0.35756100 1.0 Mn Mn2 1 0.64243900 0.64243900 0.64243900 1.0 Mn Mn3 1 0.85756100 0.85756100 0.85756100 1.0 Cu Cu4 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.50000000 0.50000000 0.50000000 1.0 P P6 1 0.03907200 0.46092800 0.75000000 1.0 P P7 1 0.46092800 0.75000000 0.03907200 1.0 P P8 1 0.75000000 0.03907200 0.46092800 1.0 P P9 1 0.25000000 0.96092800 0.53907200 1.0 P P10 1 0.53907200 0.25000000 0.96092800 1.0 P P11 1 0.96092800 0.53907200 0.25000000 1.0 O O12 1 0.12126400 0.51048100 0.30233000 1.0 O O13 1 0.30233000 0.12126400 0.51048100 1.0 O O14 1 0.05465600 0.26344900 0.91800400 1.0 O O15 1 0.51048100 0.30233000 0.12126400 1.0 O O16 1 0.01048100 0.62126400 0.80233000 1.0 O O17 1 0.23655100 0.44534400 0.58199600 1.0 O O18 1 0.26344900 0.91800400 0.05465600 1.0 O O19 1 0.44534400 0.58199600 0.23655100 1.0 O O20 1 0.19767000 0.98951900 0.37873600 1.0 O O21 1 0.58199600 0.23655100 0.44534400 1.0 O O22 1 0.08199600 0.94534400 0.73655100 1.0 O O23 1 0.37873600 0.19767000 0.98951900 1.0 O O24 1 0.62126400 0.80233000 0.01048100 1.0 O O25 1 0.91800400 0.05465600 0.26344900 1.0 O O26 1 0.41800400 0.76344900 0.55465600 1.0 O O27 1 0.80233000 0.01048100 0.62126400 1.0 O O28 1 0.55465600 0.41800400 0.76344900 1.0 O O29 1 0.73655100 0.08199600 0.94534400 1.0 O O30 1 0.76344900 0.55465600 0.41800400 1.0 O O31 1 0.98951900 0.37873600 0.19767000 1.0 O O32 1 0.48951900 0.69767000 0.87873600 1.0 O O33 1 0.94534400 0.73655100 0.08199600 1.0 O O34 1 0.69767000 0.87873600 0.48951900 1.0 O O35 1 0.87873600 0.48951900 0.69767000 1.0