# generated using pymatgen data_ScV2O2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.47598444 _cell_length_b 7.47598444 _cell_length_c 7.47598444 _cell_angle_alpha 114.27548523 _cell_angle_beta 114.27548523 _cell_angle_gamma 100.23880497 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScV2O2 _chemical_formula_sum 'Sc4 V8 O8' _cell_volume 315.53341365 _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 Sc Sc0 1 0.87500000 0.12500000 0.75000000 1.0 Sc Sc1 1 0.37500000 0.12500000 0.25000000 1.0 Sc Sc2 1 0.87500000 0.62500000 0.75000000 1.0 Sc Sc3 1 0.87500000 0.12500000 0.25000000 1.0 V V4 1 0.70003900 0.48859000 0.21145000 1.0 V V5 1 0.27714000 0.48859000 0.78855000 1.0 V V6 1 0.23859000 0.52714000 0.28855000 1.0 V V7 1 0.47286000 0.76141000 0.71145000 1.0 V V8 1 0.04996100 0.76141000 0.28855000 1.0 V V9 1 0.23859000 0.95003900 0.71145000 1.0 V V10 1 0.51141000 0.72286000 0.21145000 1.0 V V11 1 0.51141000 0.29996100 0.78855000 1.0 O O12 1 0.68380600 0.34094600 0.34286000 1.0 O O13 1 0.99808500 0.34094600 0.65714000 1.0 O O14 1 0.09094600 0.24808500 0.15714000 1.0 O O15 1 0.75191500 0.90905400 0.84286000 1.0 O O16 1 0.06619400 0.90905400 0.15714000 1.0 O O17 1 0.09094600 0.93380600 0.84286000 1.0 O O18 1 0.65905400 0.00191500 0.34286000 1.0 O O19 1 0.65905400 0.31619400 0.65714000 1.0