# generated using pymatgen data_Cr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.55639800 _cell_length_b 8.59945100 _cell_length_c 8.59945100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr _chemical_formula_sum Cr28 _cell_volume 336.94817230 _cell_formula_units_Z 28 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 Cr Cr0 1 0.50000000 0.10286200 0.89713800 1.0 Cr Cr1 1 0.50000000 0.89713800 0.10286200 1.0 Cr Cr2 1 0.00000000 0.39713800 0.39713800 1.0 Cr Cr3 1 0.00000000 0.60286200 0.60286200 1.0 Cr Cr4 1 0.50000000 0.37384400 0.96538200 1.0 Cr Cr5 1 0.50000000 0.62615600 0.03461800 1.0 Cr Cr6 1 0.00000000 0.12615600 0.46538200 1.0 Cr Cr7 1 0.00000000 0.87384400 0.53461800 1.0 Cr Cr8 1 0.50000000 0.96538200 0.37384400 1.0 Cr Cr9 1 0.50000000 0.03461800 0.62615600 1.0 Cr Cr10 1 0.00000000 0.46538200 0.12615600 1.0 Cr Cr11 1 0.00000000 0.53461800 0.87384400 1.0 Cr Cr12 1 0.50000000 0.44495900 0.25567600 1.0 Cr Cr13 1 0.50000000 0.55504100 0.74432400 1.0 Cr Cr14 1 0.00000000 0.05504100 0.75567600 1.0 Cr Cr15 1 0.00000000 0.94495900 0.24432400 1.0 Cr Cr16 1 0.50000000 0.25567600 0.44495900 1.0 Cr Cr17 1 0.50000000 0.74432400 0.55504100 1.0 Cr Cr18 1 0.00000000 0.75567600 0.05504100 1.0 Cr Cr19 1 0.00000000 0.24432400 0.94495900 1.0 Cr Cr20 1 0.24578900 0.31277400 0.68722600 1.0 Cr Cr21 1 0.24578900 0.68722600 0.31277400 1.0 Cr Cr22 1 0.74578900 0.18722600 0.18722600 1.0 Cr Cr23 1 0.74578900 0.81277400 0.81277400 1.0 Cr Cr24 1 0.75421100 0.68722600 0.31277400 1.0 Cr Cr25 1 0.75421100 0.31277400 0.68722600 1.0 Cr Cr26 1 0.25421100 0.81277400 0.81277400 1.0 Cr Cr27 1 0.25421100 0.18722600 0.18722600 1.0