# generated using pymatgen data_Mg(PO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.60852936 _cell_length_b 12.60852936 _cell_length_c 12.60852936 _cell_angle_alpha 131.58209005 _cell_angle_beta 131.58209005 _cell_angle_gamma 70.88987648 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(PO5)2 _chemical_formula_sum 'Mg4 P8 O40' _cell_volume 1098.35662789 _cell_formula_units_Z 4 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 Mg Mg0 1 0.25000000 0.75000000 0.50000000 1.0 Mg Mg1 1 0.75000000 0.25000000 0.50000000 1.0 Mg Mg2 1 0.50000000 0.50000000 0.00000000 1.0 Mg Mg3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.12500000 0.62623700 0.00123700 1.0 P P5 1 0.62500000 0.62376300 0.49876300 1.0 P P6 1 0.12500000 0.12623700 0.50123700 1.0 P P7 1 0.62500000 0.12376300 0.99876300 1.0 P P8 1 0.37376300 0.37500000 0.49876300 1.0 P P9 1 0.37623700 0.87500000 0.00123700 1.0 P P10 1 0.87376300 0.37500000 0.99876300 1.0 P P11 1 0.87623700 0.87500000 0.50123700 1.0 O O12 1 0.35179100 0.85179100 0.50000000 1.0 O O13 1 0.85179100 0.35179100 0.50000000 1.0 O O14 1 0.39820900 0.39820900 0.00000000 1.0 O O15 1 0.89820900 0.89820900 0.00000000 1.0 O O16 1 0.14820900 0.64820900 0.50000000 1.0 O O17 1 0.64820900 0.14820900 0.50000000 1.0 O O18 1 0.60179100 0.60179100 0.00000000 1.0 O O19 1 0.10179100 0.10179100 0.00000000 1.0 O O20 1 0.04951600 0.74965100 0.29618200 1.0 O O21 1 0.54951600 0.25333400 0.29986500 1.0 O O22 1 0.29653100 0.49666600 0.79618200 1.0 O O23 1 0.79653100 0.00034900 0.79986500 1.0 O O24 1 0.45346900 0.75333400 0.70381800 1.0 O O25 1 0.95346900 0.24965100 0.70013500 1.0 O O26 1 0.70048400 0.50034900 0.20381800 1.0 O O27 1 0.20048400 0.99666600 0.20013500 1.0 O O28 1 0.25034900 0.54653100 0.29986500 1.0 O O29 1 0.74666600 0.04653100 0.29618200 1.0 O O30 1 0.50333400 0.29951600 0.79986500 1.0 O O31 1 0.99965100 0.79951600 0.79618200 1.0 O O32 1 0.24666600 0.95048400 0.70013500 1.0 O O33 1 0.75034900 0.45048400 0.70381800 1.0 O O34 1 0.49965100 0.70346900 0.20013500 1.0 O O35 1 0.00333400 0.20346900 0.20381800 1.0 O O36 1 0.17992800 0.65680500 0.16987800 1.0 O O37 1 0.67992800 0.51005000 0.52312200 1.0 O O38 1 0.26307300 0.23995000 0.66987800 1.0 O O39 1 0.76307300 0.09319500 0.02312200 1.0 O O40 1 0.48692800 0.01005000 0.83012200 1.0 O O41 1 0.98692800 0.15680500 0.47687800 1.0 O O42 1 0.57007200 0.59319500 0.33012200 1.0 O O43 1 0.07007200 0.73995000 0.97687800 1.0 O O44 1 0.34319500 0.51307200 0.52312200 1.0 O O45 1 0.48995000 0.01307300 0.16987800 1.0 O O46 1 0.76005000 0.42992800 0.02312200 1.0 O O47 1 0.90680500 0.92992800 0.66987800 1.0 O O48 1 0.98995000 0.82007200 0.47687800 1.0 O O49 1 0.84319500 0.32007200 0.83012200 1.0 O O50 1 0.40680500 0.73692800 0.97687800 1.0 O O51 1 0.26005000 0.23692800 0.33012200 1.0