# generated using pymatgen data_Li2VCrP2(HO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.94921500 _cell_length_b 7.38147038 _cell_length_c 7.97392461 _cell_angle_alpha 91.02833206 _cell_angle_beta 92.70858686 _cell_angle_gamma 117.22489442 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2VCrP2(HO5)2 _chemical_formula_sum 'Li4 V2 Cr2 P4 H4 O20' _cell_volume 362.94605721 _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 Li Li0 1 0.07305900 0.82224600 0.67437100 1.0 Li Li1 1 0.42860100 0.17717900 0.82526200 1.0 Li Li2 1 0.57139900 0.82282100 0.17473800 1.0 Li Li3 1 0.92694100 0.17775400 0.32562900 1.0 V V4 1 0.00000000 0.00000000 0.00000000 1.0 V V5 1 0.50000000 0.50000000 0.50000000 1.0 Cr Cr6 1 0.00000000 0.50000000 0.00000000 1.0 Cr Cr7 1 0.50000000 0.00000000 0.50000000 1.0 P P8 1 0.47911600 0.76701800 0.84170500 1.0 P P9 1 0.01784600 0.23257200 0.65838700 1.0 P P10 1 0.98215400 0.76742800 0.34161300 1.0 P P11 1 0.52088400 0.23298200 0.15829500 1.0 H H12 1 0.79050500 0.65918800 0.84922200 1.0 H H13 1 0.29090400 0.66304700 0.34932600 1.0 H H14 1 0.70909600 0.33695300 0.65067400 1.0 H H15 1 0.20949500 0.34081200 0.15077800 1.0 O O16 1 0.32312300 0.65815800 0.98049700 1.0 O O17 1 0.11329500 0.11973300 0.77322800 1.0 O O18 1 0.38533400 0.87952800 0.72558700 1.0 O O19 1 0.68679100 0.92603900 0.94107200 1.0 O O20 1 0.18908900 0.92793800 0.44103500 1.0 O O21 1 0.53429600 0.61885900 0.73871600 1.0 O O22 1 0.17511400 0.34282200 0.51967100 1.0 O O23 1 0.03439800 0.61871300 0.23812800 1.0 O O24 1 0.94320300 0.72259500 0.89539600 1.0 O O25 1 0.44442500 0.72820300 0.39293100 1.0 O O26 1 0.55557500 0.27179700 0.60706900 1.0 O O27 1 0.05679700 0.27740500 0.10460400 1.0 O O28 1 0.96560200 0.38128700 0.76187200 1.0 O O29 1 0.82488600 0.65717800 0.48032900 1.0 O O30 1 0.46570400 0.38114100 0.26128400 1.0 O O31 1 0.81091100 0.07206200 0.55896500 1.0 O O32 1 0.31320900 0.07396100 0.05892800 1.0 O O33 1 0.61466600 0.12047200 0.27441300 1.0 O O34 1 0.88670500 0.88026700 0.22677200 1.0 O O35 1 0.67687700 0.34184200 0.01950300 1.0