# CIF generated by HEAS from Alexandria entry agm003272002 data_agm003272002 _cell_length_a 4.78736 _cell_length_b 13.41710 _cell_length_c 13.41710 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 861.81282 _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 0.03758 0.77246 0.00000 1.00000 Tl2 Tl 0.03758 0.22754 0.00000 1.00000 Tl3 Tl 0.53758 0.50000 0.27246 1.00000 Tl4 Tl 0.53758 0.50000 0.72754 1.00000 Tl5 Tl 0.46242 0.72754 0.50000 1.00000 Tl6 Tl 0.46242 0.27246 0.50000 1.00000 Tl7 Tl 0.96242 0.00000 0.77246 1.00000 Tl8 Tl 0.96242 0.00000 0.22754 1.00000 O1 O 0.83827 0.38390 0.00000 1.00000 O2 O 0.83827 0.61610 0.00000 1.00000 O3 O 0.33827 0.50000 0.88390 1.00000 O4 O 0.33827 0.50000 0.11610 1.00000 O5 O 0.66173 0.11610 0.50000 1.00000 O6 O 0.66173 0.88390 0.50000 1.00000 O7 O 0.16173 0.00000 0.38390 1.00000 O8 O 0.16173 0.00000 0.61610 1.00000 O9 O 0.72711 0.88538 0.00000 1.00000 O10 O 0.72711 0.11462 0.00000 1.00000 O11 O 0.22711 0.50000 0.38538 1.00000 O12 O 0.22711 0.50000 0.61462 1.00000 O13 O 0.77289 0.61462 0.50000 1.00000 O14 O 0.77289 0.38538 0.50000 1.00000 O15 O 0.27289 0.00000 0.88538 1.00000 O16 O 0.27289 0.00000 0.11462 1.00000 O17 O 0.22091 0.76002 0.36459 1.00000 O18 O 0.22091 0.23998 0.63541 1.00000 O19 O 0.72091 0.13541 0.26002 1.00000 O20 O 0.72091 0.86459 0.73998 1.00000 O21 O 0.27909 0.73998 0.86459 1.00000 O22 O 0.27909 0.26002 0.13541 1.00000 O23 O 0.77909 0.36459 0.76002 1.00000 O24 O 0.77909 0.63541 0.23998 1.00000 O25 O 0.27909 0.73998 0.13541 1.00000 O26 O 0.27909 0.26002 0.86459 1.00000 O27 O 0.77909 0.36459 0.23998 1.00000 O28 O 0.77909 0.63541 0.76002 1.00000 O29 O 0.22091 0.76002 0.63541 1.00000 O30 O 0.22091 0.23998 0.36459 1.00000 O31 O 0.72091 0.13541 0.73998 1.00000 O32 O 0.72091 0.86459 0.26002 1.00000 Li1 Li 0.00000 0.23811 0.76189 1.00000 Li2 Li 0.00000 0.76189 0.23811 1.00000 Li3 Li 0.50000 0.73811 0.73811 1.00000 Li4 Li 0.50000 0.26189 0.26189 1.00000 Li5 Li 0.50000 0.26189 0.73811 1.00000 Li6 Li 0.50000 0.73811 0.26189 1.00000 Li7 Li 0.00000 0.76189 0.76189 1.00000 Li8 Li 0.00000 0.23811 0.23811 1.00000 Li9 Li 0.09505 0.50000 0.00000 1.00000 Li10 Li 0.59505 0.50000 0.00000 1.00000 Li11 Li 0.40495 0.00000 0.50000 1.00000 Li12 Li 0.90495 0.00000 0.50000 1.00000 Li13 Li 0.50000 0.00000 0.00000 1.00000 Li14 Li 0.00000 0.50000 0.50000 1.00000 Li15 Li 0.00000 0.00000 0.00000 1.00000 Li16 Li 0.50000 0.50000 0.50000 1.00000 Li17 Li 0.06456 0.39148 0.86000 1.00000 Li18 Li 0.06456 0.60852 0.14000 1.00000 Li19 Li 0.56456 0.64000 0.89148 1.00000 Li20 Li 0.56456 0.36000 0.10852 1.00000 Li21 Li 0.43544 0.10852 0.36000 1.00000 Li22 Li 0.43544 0.89148 0.64000 1.00000 Li23 Li 0.93544 0.86000 0.39148 1.00000 Li24 Li 0.93544 0.14000 0.60852 1.00000 Li25 Li 0.43544 0.10852 0.64000 1.00000 Li26 Li 0.43544 0.89148 0.36000 1.00000 Li27 Li 0.93544 0.86000 0.60852 1.00000 Li28 Li 0.93544 0.14000 0.39148 1.00000 Li29 Li 0.06456 0.39148 0.14000 1.00000 Li30 Li 0.06456 0.60852 0.86000 1.00000 Li31 Li 0.56456 0.64000 0.10852 1.00000 Li32 Li 0.56456 0.36000 0.89148 1.00000 Li33 Li 0.00000 0.62958 0.37042 1.00000 Li34 Li 0.00000 0.37042 0.62958 1.00000 Li35 Li 0.50000 0.12958 0.12958 1.00000 Li36 Li 0.50000 0.87042 0.87042 1.00000 Li37 Li 0.50000 0.87042 0.12958 1.00000 Li38 Li 0.50000 0.12958 0.87042 1.00000 Li39 Li 0.00000 0.37042 0.37042 1.00000 Li40 Li 0.00000 0.62958 0.62958 1.00000