# CIF generated by HEAS from Alexandria entry agm005643179 data_agm005643179 _cell_length_a 3.87944 _cell_length_b 5.45862 _cell_length_c 6.69140 _cell_angle_alpha 114.07197 _cell_angle_beta 106.85097 _cell_angle_gamma 89.99999 _cell_volume 122.68262 _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 Y1 Y 0.50000 0.00000 0.00000 1.00000 Tm1 Tm 0.16375 0.66373 0.32746 1.00000 Tm2 Tm 0.83625 0.33627 0.67254 1.00000 S1 S 0.50000 0.50000 0.00000 1.00000 S2 S 0.17125 0.17127 0.34253 1.00000 S3 S 0.82875 0.82873 0.65747 1.00000