# generated using pymatgen data_VCrO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.11809900 _cell_length_b 5.50042667 _cell_length_c 8.82918951 _cell_angle_alpha 105.49564475 _cell_angle_beta 89.93937640 _cell_angle_gamma 117.65709477 _symmetry_Int_Tables_number 1 _chemical_formula_structural VCrO3 _chemical_formula_sum 'V4 Cr4 O12' _cell_volume 209.94192075 _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 V V0 1 0.27390400 0.70136800 0.42552200 1.0 V V1 1 0.78076000 0.70450600 0.92474600 1.0 V V2 1 0.47768500 0.29631400 0.82643200 1.0 V V3 1 0.72261200 0.29826100 0.57360500 1.0 Cr Cr4 1 0.97586500 0.30457200 0.32452600 1.0 Cr Cr5 1 0.02393100 0.69510600 0.67542700 1.0 Cr Cr6 1 0.52277000 0.69870400 0.17387700 1.0 Cr Cr7 1 0.22695500 0.30057400 0.07572800 1.0 O O8 1 0.52705100 0.19901400 0.27657700 1.0 O O9 1 0.02582200 0.19817300 0.77612500 1.0 O O10 1 0.57275400 0.49945500 0.62618400 1.0 O O11 1 0.93311400 0.49953200 0.87566600 1.0 O O12 1 0.47552600 0.20054900 0.02610500 1.0 O O13 1 0.97092800 0.19283800 0.52687100 1.0 O O14 1 0.02547500 0.80575400 0.47280400 1.0 O O15 1 0.52408800 0.80065500 0.97459200 1.0 O O16 1 0.07302400 0.50027700 0.12523400 1.0 O O17 1 0.42485100 0.50078700 0.37318400 1.0 O O18 1 0.97149100 0.80158700 0.22387300 1.0 O O19 1 0.47139200 0.80197100 0.72292200 1.0