# CIF generated by HEAS from Alexandria entry agm003898705 data_agm003898705 _cell_length_a 7.14528 _cell_length_b 7.14520 _cell_length_c 3.76239 _cell_angle_alpha 74.73635 _cell_angle_beta 74.73419 _cell_angle_gamma 30.52947 _cell_volume 93.87253 _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 Mo1 Mo 0.67471 0.67471 0.32529 1.00000 Ba1 Ba 0.99564 0.99564 0.00436 1.00000 Br1 Br 0.32965 0.32965 0.67035 1.00000