# generated using pymatgen data_AlV2O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.80799452 _cell_length_b 10.15662777 _cell_length_c 5.82868698 _cell_angle_alpha 89.93891426 _cell_angle_beta 59.98198998 _cell_angle_gamma 73.36360251 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlV2O4 _chemical_formula_sum 'Al4 V8 O16' _cell_volume 281.03223816 _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 Al Al0 1 0.61671464 0.31404492 0.94359105 1.0 Al Al1 1 0.63110548 0.80683064 0.43356422 1.0 Al Al2 1 0.37032125 0.18360018 0.57104157 1.0 Al Al3 1 0.37146609 0.69019722 0.05923420 1.0 V V4 1 0.99365193 -0.00001525 0.00297847 1.0 V V5 1 0.00313852 0.49985114 0.50500210 1.0 V V6 1 0.50438818 0.49795707 0.49439024 1.0 V V7 1 0.99862719 0.99671370 0.50842456 1.0 V V8 1 1.00038975 0.75718400 0.74325379 1.0 V V9 1 0.51276082 0.99641777 0.99940487 1.0 V V10 1 0.00280958 0.50239717 0.98143101 1.0 V V11 1 0.98888174 0.25165292 0.26143639 1.0 O O12 1 0.24772066 0.12262576 0.38121721 1.0 O O13 1 0.25171517 0.63060944 0.86554061 1.0 O O14 1 0.75184114 0.37446015 0.11878476 1.0 O O15 1 0.74848587 0.87379864 0.62005533 1.0 O O16 1 0.74602819 0.37447899 0.63168285 1.0 O O17 1 0.75242205 0.87276677 0.12845557 1.0 O O18 1 0.25339967 0.36878709 0.62193805 1.0 O O19 1 0.25274171 0.87582053 0.12262124 1.0 O O20 1 0.74628216 0.12421845 0.38558697 1.0 O O21 1 0.74875048 0.63065935 0.86954772 1.0 O O22 1 0.74351342 0.12881032 0.88271466 1.0 O O23 1 0.76471470 0.62228926 0.36245155 1.0 O O24 1 0.24811601 0.12372958 0.88811430 1.0 O O25 1 0.25366032 0.62741675 0.36821257 1.0 O O26 1 0.23833006 0.37787926 0.12610159 1.0 O O27 1 0.25802722 0.87481917 0.62322456 1.0