# generated using pymatgen data_Yb2PO4F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.69508774 _cell_length_b 7.69507316 _cell_length_c 10.17631064 _cell_angle_alpha 61.04362828 _cell_angle_beta 61.04354797 _cell_angle_gamma 49.91895016 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb2PO4F _chemical_formula_sum 'Yb8 P4 O16 F4' _cell_volume 389.81112991 _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 Yb Yb0 1 0.21375663 0.70059951 0.96138980 1.0 Yb Yb1 1 0.29940149 0.78624237 0.53861020 1.0 Yb Yb2 1 0.78624337 0.29940049 0.03861020 1.0 Yb Yb3 1 0.70059851 0.21375763 0.46138980 1.0 Yb Yb4 1 0.01141606 0.27769089 0.67320626 1.0 Yb Yb5 1 0.72231011 0.98858194 0.82679574 1.0 Yb Yb6 1 0.98858394 0.72230911 0.32679374 1.0 Yb Yb7 1 0.27768989 0.01141806 0.17320426 1.0 P P8 1 0.24084316 0.40800157 0.81536723 1.0 P P9 1 0.59199743 0.75915384 0.68463477 1.0 P P10 1 0.75915684 0.59199843 0.18463277 1.0 P P11 1 0.40800257 0.24084616 0.31536523 1.0 O O12 1 0.73291185 0.64352336 0.54863734 1.0 O O13 1 0.35647365 0.26709115 0.95136166 1.0 O O14 1 0.26708815 0.35647664 0.45136266 1.0 O O15 1 0.64352635 0.73290885 0.04863834 1.0 O O16 1 0.90659548 0.67377072 0.16549152 1.0 O O17 1 0.32622828 0.09340352 0.33450948 1.0 O O18 1 0.09340452 0.32622928 0.83450848 1.0 O O19 1 0.67377172 0.90659648 0.66549052 1.0 O O20 1 0.55986374 0.62205298 0.33550050 1.0 O O21 1 0.37794702 0.44013426 0.16450050 1.0 O O22 1 0.44013626 0.37794702 0.66449950 1.0 O O23 1 0.62205298 0.55986574 0.83549950 1.0 O O24 1 0.90572052 0.32846158 0.19333128 1.0 O O25 1 0.67153642 0.09428048 0.30666872 1.0 O O26 1 0.09427948 0.67153842 0.80666872 1.0 O O27 1 0.32846358 0.90571952 0.69333128 1.0 F F28 1 0.07105496 0.88693177 0.40156401 1.0 F F29 1 0.11306923 0.92894604 0.09843499 1.0 F F30 1 0.92894504 0.11306823 0.59843599 1.0 F F31 1 0.88693077 0.07105396 0.90156501 1.0