# generated using pymatgen data_MnNi5(BO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.00918800 _cell_length_b 9.22649700 _cell_length_c 12.41051000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnNi5(BO5)2 _chemical_formula_sum 'Mn2 Ni10 B4 O20' _cell_volume 344.56867669 _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 0.00000000 0.00892800 0.61346700 1.0 Mn Mn1 1 0.00000000 0.99107200 0.11346700 1.0 Ni Ni2 1 0.50000000 0.25492800 0.49855900 1.0 Ni Ni3 1 0.50000000 0.74507200 0.99855900 1.0 Ni Ni4 1 0.50000000 0.25508900 0.22004800 1.0 Ni Ni5 1 0.50000000 0.25352500 0.78188900 1.0 Ni Ni6 1 0.50000000 0.74647500 0.28188900 1.0 Ni Ni7 1 0.50000000 0.74491100 0.72004800 1.0 Ni Ni8 1 0.00000000 0.74493400 0.49865000 1.0 Ni Ni9 1 0.00000000 0.25506600 0.99865000 1.0 Ni Ni10 1 0.00000000 0.49030400 0.38615500 1.0 Ni Ni11 1 0.00000000 0.50969600 0.88615500 1.0 B B12 1 0.00000000 0.52636700 0.13987000 1.0 B B13 1 0.00000000 0.97639500 0.86028700 1.0 B B14 1 0.00000000 0.02360500 0.36028800 1.0 B B15 1 0.00000000 0.47363300 0.63987000 1.0 O O16 1 0.50000000 0.63608600 0.42251200 1.0 O O17 1 0.50000000 0.86935100 0.57852700 1.0 O O18 1 0.50000000 0.13064900 0.07852700 1.0 O O19 1 0.50000000 0.36391400 0.92251200 1.0 O O20 1 0.50000000 0.35819100 0.35733900 1.0 O O21 1 0.50000000 0.13949600 0.64281200 1.0 O O22 1 0.50000000 0.86050400 0.14281200 1.0 O O23 1 0.50000000 0.64180900 0.85733900 1.0 O O24 1 0.00000000 0.60065900 0.23641100 1.0 O O25 1 0.00000000 0.89858300 0.76384900 1.0 O O26 1 0.00000000 0.10141700 0.26384900 1.0 O O27 1 0.00000000 0.39934100 0.73641100 1.0 O O28 1 0.00000000 0.37448300 0.14084600 1.0 O O29 1 0.00000000 0.12544100 0.85876700 1.0 O O30 1 0.00000000 0.87455900 0.35876700 1.0 O O31 1 0.00000000 0.62551700 0.64084600 1.0 O O32 1 0.00000000 0.39885500 0.54324300 1.0 O O33 1 0.00000000 0.10135800 0.45676800 1.0 O O34 1 0.00000000 0.89864200 0.95676800 1.0 O O35 1 0.00000000 0.60114500 0.04324300 1.0