# CIF generated by HEAS from Alexandria entry agm011107948 data_agm011107948 _cell_length_a 3.88429 _cell_length_b 3.88429 _cell_length_c 7.84507 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 118.36434 _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 Th1 Th 0.50000 0.00000 0.82206 1.00000 Th2 Th 0.00000 0.50000 0.17794 1.00000 Ni1 Ni 0.00000 0.00000 0.50000 1.00000 Ni2 Ni 0.50000 0.50000 0.50000 1.00000 S1 S 0.00000 0.50000 0.66044 1.00000 S2 S 0.50000 0.00000 0.33956 1.00000 O1 O 0.00000 0.00000 0.00000 1.00000 O2 O 0.50000 0.50000 0.00000 1.00000