# CIF generated by HEAS from Alexandria entry agm005180613 data_agm005180613 _cell_length_a 4.31301 _cell_length_b 4.31366 _cell_length_c 4.99721 _cell_angle_alpha 90.00855 _cell_angle_beta 90.00036 _cell_angle_gamma 119.99651 _cell_volume 80.51914 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba1 Ba 0.57194 0.14388 0.34371 1.00000 Cu1 Cu 0.23852 0.47705 0.87673 1.00000 As1 As 0.90522 0.81045 0.81816 1.00000 H1 H 0.23864 0.47728 0.20053 1.00000