# generated using pymatgen data_Sb(PO3)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.04988700 _cell_length_b 9.42801600 _cell_length_c 10.45525562 _cell_angle_alpha 65.81681014 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sb(PO3)5 _chemical_formula_sum 'Sb4 P20 O60' _cell_volume 1263.38894789 _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 Sb Sb0 1 0.00022000 0.49890400 0.25063900 1.0 Sb Sb1 1 0.99978000 0.50109600 0.74936100 1.0 Sb Sb2 1 0.50022000 0.50109600 0.24936100 1.0 Sb Sb3 1 0.49978000 0.49890400 0.75063900 1.0 P P4 1 0.58873500 0.17327900 0.99098100 1.0 P P5 1 0.64552600 0.47836300 0.00332700 1.0 P P6 1 0.91126500 0.17327900 0.49098100 1.0 P P7 1 0.41435200 0.82467800 0.50589400 1.0 P P8 1 0.41126500 0.82672100 0.00901900 1.0 P P9 1 0.25114200 0.01354200 0.52247000 1.0 P P10 1 0.08873500 0.82672100 0.50901900 1.0 P P11 1 0.14552600 0.52163700 0.49667300 1.0 P P12 1 0.75114200 0.98645800 0.97753000 1.0 P P13 1 0.58564800 0.17532200 0.49410600 1.0 P P14 1 0.35551800 0.51937900 0.49589200 1.0 P P15 1 0.74885800 0.98645800 0.47753000 1.0 P P16 1 0.91435200 0.17532200 0.99410600 1.0 P P17 1 0.35447400 0.52163700 0.99667300 1.0 P P18 1 0.24885800 0.01354200 0.02247000 1.0 P P19 1 0.14448200 0.51937900 0.99589200 1.0 P P20 1 0.64448200 0.48062100 0.50410800 1.0 P P21 1 0.08564800 0.82467800 0.00589400 1.0 P P22 1 0.85447400 0.47836300 0.50332700 1.0 P P23 1 0.85551800 0.48062100 0.00410800 1.0 O O24 1 0.01332200 0.72177000 0.62108500 1.0 O O25 1 0.37678300 0.50687900 0.85927600 1.0 O O26 1 0.42176000 0.42876300 0.11779500 1.0 O O27 1 0.12321700 0.50687900 0.35927600 1.0 O O28 1 0.46095000 0.93256600 0.37936800 1.0 O O29 1 0.66132000 0.12323700 0.41301800 1.0 O O30 1 0.01323700 0.71924300 0.12262700 1.0 O O31 1 0.37677000 0.50285200 0.35903300 1.0 O O32 1 0.74963700 0.54581900 0.45918700 1.0 O O33 1 0.53905000 0.06743400 0.62063200 1.0 O O34 1 0.87678300 0.49312100 0.64072400 1.0 O O35 1 0.83636000 0.12382600 0.40677400 1.0 O O36 1 0.24635300 0.10999800 0.10308800 1.0 O O37 1 0.75364700 0.89000200 0.89691200 1.0 O O38 1 0.04469000 0.93753100 0.38116300 1.0 O O39 1 0.07769800 0.42645700 0.11779500 1.0 O O40 1 0.75198100 0.92567200 0.63217500 1.0 O O41 1 0.57769800 0.57354300 0.38220500 1.0 O O42 1 0.48667800 0.72177000 0.12108500 1.0 O O43 1 0.64919800 0.30745800 0.52859200 1.0 O O44 1 0.16132000 0.87676300 0.08698200 1.0 O O45 1 0.95531000 0.06246900 0.61883700 1.0 O O46 1 0.16364000 0.87617400 0.59322600 1.0 O O47 1 0.25036300 0.45418100 0.54081300 1.0 O O48 1 0.33868000 0.87676300 0.58698200 1.0 O O49 1 0.03905000 0.93256600 0.87936800 1.0 O O50 1 0.83868000 0.12323700 0.91301800 1.0 O O51 1 0.65251800 0.30646100 0.02415100 1.0 O O52 1 0.85080200 0.30745800 0.02859200 1.0 O O53 1 0.51323700 0.28075700 0.37737300 1.0 O O54 1 0.48676300 0.71924300 0.62262700 1.0 O O55 1 0.24801900 0.07432800 0.36782500 1.0 O O56 1 0.92230200 0.57354300 0.88220500 1.0 O O57 1 0.45531000 0.93753100 0.88116300 1.0 O O58 1 0.74801900 0.92567200 0.13217500 1.0 O O59 1 0.12323000 0.50285200 0.85903300 1.0 O O60 1 0.07824000 0.42876300 0.61779500 1.0 O O61 1 0.54469000 0.06246900 0.11883700 1.0 O O62 1 0.14919800 0.69254200 0.97140800 1.0 O O63 1 0.62323000 0.49714800 0.64096700 1.0 O O64 1 0.24963700 0.45418100 0.04081300 1.0 O O65 1 0.75036300 0.54581900 0.95918700 1.0 O O66 1 0.98676300 0.28075700 0.87737300 1.0 O O67 1 0.57824000 0.57123700 0.88220500 1.0 O O68 1 0.51332200 0.27823000 0.87891500 1.0 O O69 1 0.33636000 0.87617400 0.09322600 1.0 O O70 1 0.42230200 0.42645700 0.61779500 1.0 O O71 1 0.25198100 0.07432800 0.86782500 1.0 O O72 1 0.96095000 0.06743400 0.12063200 1.0 O O73 1 0.92176000 0.57123700 0.38220500 1.0 O O74 1 0.66364000 0.12382600 0.90677400 1.0 O O75 1 0.62321700 0.49312100 0.14072400 1.0 O O76 1 0.35080200 0.69254200 0.47140800 1.0 O O77 1 0.74635300 0.89000200 0.39691200 1.0 O O78 1 0.98667800 0.27823000 0.37891500 1.0 O O79 1 0.34748200 0.69353900 0.97584900 1.0 O O80 1 0.84748200 0.30646100 0.52415100 1.0 O O81 1 0.87677000 0.49714800 0.14096700 1.0 O O82 1 0.15251800 0.69353900 0.47584900 1.0 O O83 1 0.25364700 0.10999800 0.60308800 1.0