# CIF generated by HEAS from Alexandria entry agm004053906 data_agm004053906 _cell_length_a 3.58064 _cell_length_b 3.57345 _cell_length_c 7.94341 _cell_angle_alpha 63.29436 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 90.79575 _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 Tl1 Tl 0.00000 0.03659 0.96390 1.00000 Tl2 Tl 0.00000 0.46341 0.53610 1.00000 Ca1 Ca 0.50000 0.25000 0.25000 1.00000 Tc1 Tc 0.50000 0.75000 0.75000 1.00000