# CIF generated by HEAS from Alexandria entry agm002829997 data_agm002829997 _cell_length_a 5.04675 _cell_length_b 5.04675 _cell_length_c 8.86723 _cell_angle_alpha 73.46669 _cell_angle_beta 73.46669 _cell_angle_gamma 90.00000 _cell_volume 206.74856 _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 0.37510 0.12500 0.25000 1.00000 Mo2 Mo 0.37490 0.62500 0.25000 1.00000 Mo3 Mo 0.37500 0.62490 0.75000 1.00000 Mo4 Mo 0.87500 0.62510 0.75000 1.00000 Ba1 Ba 0.00000 0.00000 0.00000 1.00000 Ba2 Ba 0.75000 0.25000 0.50000 1.00000 Fe1 Fe 0.50000 0.50000 0.00000 1.00000 Fe2 Fe 0.25000 0.75000 0.50000 1.00000