# CIF generated by HEAS from Alexandria entry agm005606972 data_agm005606972 _cell_length_a 8.11653 _cell_length_b 9.85294 _cell_length_c 9.21876 _cell_angle_alpha 122.30297 _cell_angle_beta 107.19028 _cell_angle_gamma 90.00001 _cell_volume 583.80483 _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 Mn1 Mn 0.63417 0.68459 0.36918 1.00000 Mn2 Mn 0.36583 0.31541 0.63082 1.00000 Tl1 Tl 0.50000 0.00000 0.00000 1.00000 Tl2 Tl 0.00000 0.71991 0.00000 1.00000 Tl3 Tl 1.00000 0.28009 1.00000 1.00000 I1 I 0.71076 0.35112 0.70225 1.00000 I2 I 0.28924 0.64888 0.29775 1.00000 I3 I 0.77989 0.86931 0.73862 1.00000 I4 I 0.22011 0.13069 0.26138 1.00000 I5 I 0.74442 0.40496 0.26561 1.00000 I6 I 0.74442 0.86065 0.26561 1.00000 I7 I 0.25558 0.13935 0.73439 1.00000 I8 I 0.25558 0.59504 0.73439 1.00000