# generated using pymatgen data_Bi2Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.26891300 _cell_length_b 7.49479551 _cell_length_c 11.85979600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 105.42634489 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi2Se _chemical_formula_sum 'Bi8 Se4' _cell_volume 365.77942265 _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 Bi Bi0 1 0.53397200 0.97299800 0.36203700 1.0 Bi Bi1 1 0.96602800 0.02700200 0.86203700 1.0 Bi Bi2 1 0.46602800 0.02700200 0.63796300 1.0 Bi Bi3 1 0.03397200 0.97299800 0.13796300 1.0 Bi Bi4 1 0.17604800 0.33141900 0.37618100 1.0 Bi Bi5 1 0.32395200 0.66858100 0.87618100 1.0 Bi Bi6 1 0.82395200 0.66858100 0.62381900 1.0 Bi Bi7 1 0.67604800 0.33141900 0.12381900 1.0 Se Se8 1 0.64617800 0.34822500 0.88880800 1.0 Se Se9 1 0.85382200 0.65177500 0.38880800 1.0 Se Se10 1 0.35382200 0.65177500 0.11119200 1.0 Se Se11 1 0.14617800 0.34822500 0.61119200 1.0