# generated using pymatgen data_AlVO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.83721000 _cell_length_b 5.87980687 _cell_length_c 13.21320636 _cell_angle_alpha 102.84629518 _cell_angle_beta 102.68481071 _cell_angle_gamma 90.05662530 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlVO3 _chemical_formula_sum 'Al8 V8 O24' _cell_volume 430.76472284 _cell_formula_units_Z 8 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 Al Al0 1 0.00806300 0.98859900 0.00758800 1.0 Al Al1 1 0.30081100 0.38015600 0.07932000 1.0 Al Al2 1 0.78216100 0.38064300 0.07901800 1.0 Al Al3 1 0.65826500 0.01639200 0.32283800 1.0 Al Al4 1 0.46056000 0.37717900 0.41561600 1.0 Al Al5 1 0.25599700 0.73880200 0.50785800 1.0 Al Al6 1 0.13459200 0.36660700 0.75560300 1.0 Al Al7 1 0.92537700 0.75481400 0.83008300 1.0 V V8 1 0.12672400 0.37983500 0.25073300 1.0 V V9 1 0.12602800 0.86789400 0.25123000 1.0 V V10 1 0.95887700 0.37819000 0.41495900 1.0 V V11 1 0.79416200 0.37141300 0.58145500 1.0 V V12 1 0.79378500 0.88466600 0.58114600 1.0 V V13 1 0.62537500 0.36646200 0.75558400 1.0 V V14 1 0.46129600 0.87215200 0.91851200 1.0 V V15 1 0.46121700 0.37210400 0.91831400 1.0 O O16 1 0.53804800 0.59961600 0.07110700 1.0 O O17 1 0.53757900 0.18518500 0.07093200 1.0 O O18 1 0.04479500 0.60416300 0.08385800 1.0 O O19 1 0.04437800 0.14620600 0.08337600 1.0 O O20 1 0.87258700 0.14130100 0.23832600 1.0 O O21 1 0.36316600 0.14370500 0.23762400 1.0 O O22 1 0.90581300 0.61050100 0.25960300 1.0 O O23 1 0.35689500 0.59396900 0.27195600 1.0 O O24 1 0.21845000 0.61416400 0.42222600 1.0 O O25 1 0.22158800 0.11899400 0.42054900 1.0 O O26 1 0.69904700 0.13981500 0.40914600 1.0 O O27 1 0.69632800 0.63510800 0.41043100 1.0 O O28 1 0.01182900 0.14490300 0.56967600 1.0 O O29 1 0.56182000 0.15969300 0.55993100 1.0 O O30 1 0.55297500 0.61581000 0.58944200 1.0 O O31 1 0.04530300 0.60961500 0.59391900 1.0 O O32 1 0.89217200 0.61447400 0.74982300 1.0 O O33 1 0.89209600 0.13583600 0.74972000 1.0 O O34 1 0.37103800 0.13974100 0.76435100 1.0 O O35 1 0.37137400 0.56722300 0.76432100 1.0 O O36 1 0.20043800 0.12580900 0.91595400 1.0 O O37 1 0.71434900 0.11838100 0.92087500 1.0 O O38 1 0.21027600 0.61732500 0.92169500 1.0 O O39 1 0.72340600 0.62092000 0.91937400 1.0