# CIF generated by HEAS from Alexandria entry agm002171985 data_agm002171985 _cell_length_a 5.26992 _cell_length_b 5.52769 _cell_length_c 5.93062 _cell_angle_alpha 59.70720 _cell_angle_beta 60.38868 _cell_angle_gamma 59.11611 _cell_volume 121.40222 _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 Ni1 Ni 0.66230 0.65572 0.02276 1.00000 Ni2 Ni 0.33770 0.34428 0.97724 1.00000 Tl1 Tl 0.87354 0.87280 0.38711 1.00000 Tl2 Tl 0.12646 0.12720 0.61289 1.00000 O1 O 0.29668 0.54401 0.22974 1.00000 O2 O 0.93656 0.30740 0.22400 1.00000 O3 O 0.51901 0.96543 0.22739 1.00000 O4 O 0.48099 0.03457 0.77261 1.00000 O5 O 0.06344 0.69260 0.77600 1.00000 O6 O 0.70332 0.45599 0.77026 1.00000