# generated using pymatgen data_Li2Nb2(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.90114052 _cell_length_b 8.90114052 _cell_length_c 8.89733165 _cell_angle_alpha 60.38625803 _cell_angle_beta 60.38625803 _cell_angle_gamma 62.12256033 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Nb2(PO4)3 _chemical_formula_sum 'Li4 Nb4 P6 O24' _cell_volume 508.99794935 _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 Li Li0 1 0.32262600 0.18490000 0.54805300 1.0 Li Li1 1 0.81510000 0.67737400 0.95194700 1.0 Li Li2 1 0.18490000 0.32262600 0.04805300 1.0 Li Li3 1 0.67737400 0.81510000 0.45194700 1.0 Nb Nb4 1 0.86041500 0.36066200 0.85796900 1.0 Nb Nb5 1 0.63933800 0.13958500 0.64203100 1.0 Nb Nb6 1 0.36066200 0.86041500 0.35796900 1.0 Nb Nb7 1 0.13958500 0.63933800 0.14203100 1.0 P P8 1 0.53415600 0.46584400 0.25000000 1.0 P P9 1 0.46584400 0.53415600 0.75000000 1.0 P P10 1 0.24328000 0.04724300 0.96307100 1.0 P P11 1 0.95275700 0.75672000 0.53692900 1.0 P P12 1 0.04724300 0.24328000 0.46307100 1.0 P P13 1 0.75672000 0.95275700 0.03692900 1.0 O O14 1 0.49899600 0.37371200 0.70227000 1.0 O O15 1 0.88616200 0.18846900 0.51138900 1.0 O O16 1 0.71597700 0.45621700 0.08689000 1.0 O O17 1 0.69824100 0.96793900 0.89095000 1.0 O O18 1 0.37371200 0.49899600 0.20227000 1.0 O O19 1 0.54378300 0.28402300 0.41311000 1.0 O O20 1 0.08756800 0.22972900 0.94511800 1.0 O O21 1 0.39641600 0.07028300 0.77091700 1.0 O O22 1 0.77027100 0.91243200 0.55488200 1.0 O O23 1 0.03206100 0.30175900 0.60905000 1.0 O O24 1 0.07028300 0.39641600 0.27091700 1.0 O O25 1 0.81153100 0.11383800 0.98861100 1.0 O O26 1 0.18846900 0.88616200 0.01138900 1.0 O O27 1 0.92971700 0.60358400 0.72908300 1.0 O O28 1 0.96793900 0.69824100 0.39095000 1.0 O O29 1 0.22972900 0.08756800 0.44511800 1.0 O O30 1 0.60358400 0.92971700 0.22908300 1.0 O O31 1 0.91243200 0.77027100 0.05488200 1.0 O O32 1 0.45621700 0.71597700 0.58689000 1.0 O O33 1 0.62628800 0.50100400 0.79773000 1.0 O O34 1 0.30175900 0.03206100 0.10905000 1.0 O O35 1 0.28402300 0.54378300 0.91311000 1.0 O O36 1 0.11383800 0.81153100 0.48861100 1.0 O O37 1 0.50100400 0.62628800 0.29773000 1.0