# generated using pymatgen data_Nb2(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.79405983 _cell_length_b 8.79717845 _cell_length_c 8.92542222 _cell_angle_alpha 90.11315073 _cell_angle_beta 118.99492425 _cell_angle_gamma 119.97734042 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2(PO4)3 _chemical_formula_sum 'Nb4 P6 O24' _cell_volume 495.24385942 _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 Nb Nb0 1 0.21611112 0.85800847 0.07757748 1.0 Nb Nb1 1 0.78374803 0.64017173 0.42264188 1.0 Nb Nb2 1 0.21625197 0.35982827 0.57735812 1.0 Nb Nb3 1 0.78388888 0.14199153 0.92242252 1.0 P P4 1 0.99909290 0.96676175 0.24910982 1.0 P P5 1 0.28227162 0.53140696 0.24716624 1.0 P P6 1 0.28224058 0.75247402 0.74483554 1.0 P P7 1 0.71775942 0.24752598 0.25516446 1.0 P P8 1 0.71772838 0.46859304 0.75283376 1.0 P P9 1 0.00090710 0.03323825 0.75089018 1.0 O O10 1 0.28935102 0.70693018 0.22157463 1.0 O O11 1 0.87078111 0.99942061 0.07856537 1.0 O O12 1 0.86849273 0.86440333 0.58593603 1.0 O O13 1 0.84475510 0.79487899 0.26694837 1.0 O O14 1 0.15039239 0.93929358 0.23540075 1.0 O O15 1 0.48074768 0.56004154 0.27499144 1.0 O O16 1 0.09310488 0.72677627 0.57412307 1.0 O O17 1 0.91066903 0.63323107 0.92257332 1.0 O O18 1 0.27605441 0.78257610 0.90923954 1.0 O O19 1 0.48429503 0.91712774 0.77211119 1.0 O O20 1 0.72728558 0.49756515 0.58896691 1.0 O O21 1 0.71634936 0.42010536 0.27556399 1.0 O O22 1 0.28365064 0.57989464 0.72443601 1.0 O O23 1 0.27271442 0.50243485 0.41103309 1.0 O O24 1 0.51570497 0.08287226 0.22788881 1.0 O O25 1 0.72394559 0.21742390 0.09076046 1.0 O O26 1 0.08933097 0.36676893 0.07742668 1.0 O O27 1 0.90689512 0.27322373 0.42587693 1.0 O O28 1 0.51925232 0.43995846 0.72500856 1.0 O O29 1 0.84960761 0.06070642 0.76459925 1.0 O O30 1 0.15524490 0.20512101 0.73305163 1.0 O O31 1 0.13150727 0.13559667 0.41406397 1.0 O O32 1 0.12921889 0.00057939 0.92143463 1.0 O O33 1 0.71064898 0.29306982 0.77842537 1.0