# CIF generated by HEAS from Alexandria entry agm006207656 data_agm006207656 _cell_length_a 3.84936 _cell_length_b 4.05398 _cell_length_c 13.23112 _cell_angle_alpha 73.49131 _cell_angle_beta 43.33410 _cell_angle_gamma 61.65382 _cell_volume 124.06222 _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 H1 H 0.50000 0.50000 0.50000 1.00000 H2 H 0.02335 0.70020 0.25062 1.00000 H3 H 0.30851 0.10361 0.45588 1.00000 H4 H 0.69149 0.89639 0.54412 1.00000 H5 H 0.63297 0.39627 0.26755 1.00000 H6 H 0.36703 0.60373 0.73245 1.00000 H7 H 0.97665 0.29980 0.74938 1.00000 Th1 Th 0.80502 0.93954 0.69008 1.00000 Th2 Th 0.19498 0.06046 0.30992 1.00000 Cl1 Cl 0.00000 0.00000 0.00000 1.00000