# generated using pymatgen data_Mn2VNi3(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.55840822 _cell_length_b 8.55840822 _cell_length_c 8.55840780 _cell_angle_alpha 60.67423087 _cell_angle_beta 60.67423087 _cell_angle_gamma 60.67422868 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2VNi3(PO4)6 _chemical_formula_sum 'Mn2 V1 Ni3 P6 O24' _cell_volume 450.01208478 _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 0.99750100 0.99750100 0.99750100 1.0 Mn Mn1 1 0.49894300 0.49894300 0.49894300 1.0 V V2 1 0.14470800 0.14470800 0.14470800 1.0 Ni Ni3 1 0.64223500 0.64223500 0.64223500 1.0 Ni Ni4 1 0.85607200 0.85607200 0.85607200 1.0 Ni Ni5 1 0.35705100 0.35705100 0.35705100 1.0 P P6 1 0.95591700 0.25145500 0.54359300 1.0 P P7 1 0.54359300 0.95591700 0.25145500 1.0 P P8 1 0.25145500 0.54359300 0.95591700 1.0 P P9 1 0.75058100 0.45687900 0.04451700 1.0 P P10 1 0.45687900 0.04451700 0.75058100 1.0 P P11 1 0.04451700 0.75058100 0.45687900 1.0 O O12 1 0.50658400 0.10729500 0.31957500 1.0 O O13 1 0.31957500 0.50658400 0.10729500 1.0 O O14 1 0.10729500 0.31957500 0.50658400 1.0 O O15 1 0.94254500 0.08896900 0.73535900 1.0 O O16 1 0.01415500 0.17998700 0.37596500 1.0 O O17 1 0.76141700 0.40755000 0.54342500 1.0 O O18 1 0.73535900 0.94254500 0.08896800 1.0 O O19 1 0.54342500 0.76141700 0.40755000 1.0 O O20 1 0.81194300 0.61112100 0.01345500 1.0 O O21 1 0.40755000 0.54342500 0.76141700 1.0 O O22 1 0.91657300 0.25586000 0.06944500 1.0 O O23 1 0.61112100 0.01345500 0.81194300 1.0 O O24 1 0.37596500 0.01415500 0.17998700 1.0 O O25 1 0.08896900 0.73535900 0.94254500 1.0 O O26 1 0.59244700 0.43702900 0.24367300 1.0 O O27 1 0.17998700 0.37596500 0.01415500 1.0 O O28 1 0.43702900 0.24367300 0.59244700 1.0 O O29 1 0.25586000 0.06944500 0.91657300 1.0 O O30 1 0.24367300 0.59244700 0.43702900 1.0 O O31 1 0.01345500 0.81194300 0.61112100 1.0 O O32 1 0.06944500 0.91657300 0.25586000 1.0 O O33 1 0.88923300 0.69557800 0.48137600 1.0 O O34 1 0.69557800 0.48137600 0.88923300 1.0 O O35 1 0.48137600 0.88923300 0.69557800 1.0