# generated using pymatgen data_ZnCr4O6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.26734341 _cell_length_b 5.26734341 _cell_length_c 15.41064700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 146.91570754 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnCr4O6 _chemical_formula_sum 'Zn2 Cr8 O12' _cell_volume 233.39695297 _cell_formula_units_Z 2 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 Zn Zn0 1 0.33854900 0.66145100 0.75000000 1.0 Zn Zn1 1 0.66145100 0.33854900 0.25000000 1.0 Cr Cr2 1 0.13633000 0.86367000 0.04578200 1.0 Cr Cr3 1 0.59552700 0.40447300 0.63528400 1.0 Cr Cr4 1 0.86367000 0.13633000 0.95421800 1.0 Cr Cr5 1 0.40447300 0.59552700 0.36471600 1.0 Cr Cr6 1 0.13633000 0.86367000 0.45421800 1.0 Cr Cr7 1 0.86367000 0.13633000 0.54578200 1.0 Cr Cr8 1 0.40447300 0.59552700 0.13528400 1.0 Cr Cr9 1 0.59552700 0.40447300 0.86471600 1.0 O O10 1 0.50000000 0.50000000 0.50000000 1.0 O O11 1 0.50000000 0.50000000 0.00000000 1.0 O O12 1 0.96017900 0.03982100 0.83999500 1.0 O O13 1 0.03982100 0.96017900 0.16000500 1.0 O O14 1 0.03982100 0.96017900 0.33999500 1.0 O O15 1 0.96017900 0.03982100 0.66000500 1.0 O O16 1 0.21511200 0.78488800 0.92038200 1.0 O O17 1 0.78488800 0.21511200 0.07961800 1.0 O O18 1 0.78488800 0.21511200 0.42038200 1.0 O O19 1 0.21511200 0.78488800 0.57961800 1.0 O O20 1 0.69923800 0.30076200 0.75000000 1.0 O O21 1 0.30076200 0.69923800 0.25000000 1.0