# generated using pymatgen data_TiCr7O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.08820000 _cell_length_b 5.46695801 _cell_length_c 7.47557814 _cell_angle_alpha 95.67222672 _cell_angle_beta 90.04823970 _cell_angle_gamma 90.00269346 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiCr7O12 _chemical_formula_sum 'Ti1 Cr7 O12' _cell_volume 206.92970332 _cell_formula_units_Z 1 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 Ti Ti0 1 0.00039600 0.70491200 0.14663100 1.0 Cr Cr1 1 0.50084600 0.80222300 0.84785100 1.0 Cr Cr2 1 0.99927000 0.29950200 0.84931400 1.0 Cr Cr3 1 0.99986100 0.69856100 0.64990400 1.0 Cr Cr4 1 0.49984500 0.20005300 0.65023700 1.0 Cr Cr5 1 0.50089400 0.79932000 0.35135500 1.0 Cr Cr6 1 0.99925100 0.30143800 0.35035300 1.0 Cr Cr7 1 0.50007800 0.20001600 0.15065900 1.0 O O8 1 0.69932500 0.50018500 0.75011600 1.0 O O9 1 0.14949200 0.65220300 0.90552200 1.0 O O10 1 0.34925700 0.85073500 0.59868800 1.0 O O11 1 0.34901200 0.15007700 0.89964900 1.0 O O12 1 0.84952700 0.65031500 0.39948200 1.0 O O13 1 0.80156900 0.00069400 0.74930100 1.0 O O14 1 0.15068200 0.35013000 0.60016700 1.0 O O15 1 0.65710300 0.84361000 0.09961700 1.0 O O16 1 0.64969000 0.14995100 0.40060800 1.0 O O17 1 0.85327100 0.35002300 0.10023300 1.0 O O18 1 0.29746500 0.50218800 0.25127200 1.0 O O19 1 0.19316700 0.99386400 0.24904200 1.0