# generated using pymatgen data_LiVP2HO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.71584400 _cell_length_b 7.98374701 _cell_length_c 7.47448577 _cell_angle_alpha 90.04382831 _cell_angle_beta 105.46432218 _cell_angle_gamma 90.04069106 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiVP2HO8 _chemical_formula_sum 'Li4 V4 P8 H4 O32' _cell_volume 558.79655548 _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 Li Li0 1 0.85634900 0.20253200 0.86904300 1.0 Li Li1 1 0.35443900 0.45395200 0.63091600 1.0 Li Li2 1 0.14277900 0.79129700 0.13023300 1.0 Li Li3 1 0.35218300 0.95323600 0.63140500 1.0 V V4 1 0.99972400 0.24632400 0.49047000 1.0 V V5 1 0.49999600 0.49853300 0.00595300 1.0 V V6 1 0.98983600 0.74624000 0.50319800 1.0 V V7 1 0.50062500 0.99914000 0.00588200 1.0 P P8 1 0.26657400 0.06541400 0.35012100 1.0 P P9 1 0.23283100 0.18586000 0.84843400 1.0 P P10 1 0.76379400 0.31703500 0.15521600 1.0 P P11 1 0.73586600 0.43376600 0.65733600 1.0 P P12 1 0.26749300 0.56754000 0.34743400 1.0 P P13 1 0.23075900 0.68267100 0.84800400 1.0 P P14 1 0.76191400 0.81292000 0.15430100 1.0 P P15 1 0.73567200 0.93597600 0.65221500 1.0 H H16 1 0.50825800 0.25973700 0.50378700 1.0 H H17 1 0.99167600 0.48753800 0.00679800 1.0 H H18 1 0.49929100 0.75001900 0.50229400 1.0 H H19 1 0.99002200 0.98621800 0.00579200 1.0 O O20 1 0.85420200 0.06990800 0.55524100 1.0 O O21 1 0.31257100 0.01147300 0.17658300 1.0 O O22 1 0.35577000 0.07963200 0.82916500 1.0 O O23 1 0.44020300 0.12935900 0.45351600 1.0 O O24 1 0.65395100 0.18137800 0.05299500 1.0 O O25 1 0.81808100 0.27229900 0.32665200 1.0 O O26 1 0.05137900 0.11779500 0.93798100 1.0 O O27 1 0.13712900 0.16457600 0.32776300 1.0 O O28 1 0.85579600 0.32734600 0.67292100 1.0 O O29 1 0.93783500 0.37563600 0.04478200 1.0 O O30 1 0.19082800 0.24425600 0.67609200 1.0 O O31 1 0.35156100 0.31794100 0.94814700 1.0 O O32 1 0.55529300 0.37117900 0.55687500 1.0 O O33 1 0.63760300 0.41744900 0.17252100 1.0 O O34 1 0.68229400 0.48264900 0.82750000 1.0 O O35 1 0.85400700 0.56615000 0.55823100 1.0 O O36 1 0.15649200 0.43252500 0.44852600 1.0 O O37 1 0.31883300 0.52242600 0.17439200 1.0 O O38 1 0.35517300 0.57899000 0.82584400 1.0 O O39 1 0.43908900 0.63094000 0.45674800 1.0 O O40 1 0.65109400 0.67980900 0.05486000 1.0 O O41 1 0.81570700 0.76792600 0.32708400 1.0 O O42 1 0.06021800 0.62296900 0.95568100 1.0 O O43 1 0.13985000 0.66931200 0.32768300 1.0 O O44 1 0.85861000 0.83240300 0.66925700 1.0 O O45 1 0.94687700 0.87909600 0.05987800 1.0 O O46 1 0.18690200 0.74076400 0.67778000 1.0 O O47 1 0.35014700 0.81749300 0.94923000 1.0 O O48 1 0.55309700 0.87136200 0.55954100 1.0 O O49 1 0.63983800 0.91728400 0.16795200 1.0 O O50 1 0.68840200 0.99242800 0.82362200 1.0 O O51 1 0.15494500 0.92939300 0.45010300 1.0