# CIF generated by HEAS from Alexandria entry agm004875441 data_agm004875441 _cell_length_a 5.99156 _cell_length_b 5.99156 _cell_length_c 7.75490 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 241.09388 _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 0.00000 0.00000 0.00000 1.00000 Nd1 Nd 0.00000 0.00000 0.50000 1.00000 Tc1 Tc 0.66667 0.33333 0.21850 1.00000 Tc2 Tc 0.33333 0.66667 0.78150 1.00000 O1 O 0.33333 0.66667 0.01044 1.00000 O2 O 0.33309 0.16794 0.29378 1.00000 O3 O 0.83206 0.16515 0.29378 1.00000 O4 O 0.66667 0.33333 0.98956 1.00000 O5 O 0.16794 0.83485 0.70622 1.00000 O6 O 0.66691 0.83206 0.70622 1.00000 O7 O 0.16515 0.33309 0.70622 1.00000 O8 O 0.83485 0.66691 0.29378 1.00000