# CIF generated by HEAS from Alexandria entry agm005663552 data_agm005663552 _cell_length_a 6.53152 _cell_length_b 8.67198 _cell_length_c 8.67198 _cell_angle_alpha 81.41505 _cell_angle_beta 67.90015 _cell_angle_gamma 67.90014 _cell_volume 421.64908 _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 Sc1 Sc 0.00095 0.83354 0.66692 1.00000 Sc2 Sc 0.49905 0.33308 0.16646 1.00000 Sc3 Sc 0.99905 0.16646 0.33308 1.00000 Sc4 Sc 0.50095 0.66692 0.83354 1.00000 Pa1 Pa 0.25000 0.24989 0.75011 1.00000 Pa2 Pa 0.75000 0.75011 0.24989 1.00000 S1 S 0.45438 0.70336 0.54663 1.00000 S2 S 0.04562 0.45337 0.29664 1.00000 S3 S 0.54562 0.29664 0.45337 1.00000 S4 S 0.95438 0.54663 0.70336 1.00000 S5 S 0.96832 0.87426 0.37544 1.00000 S6 S 0.53168 0.62456 0.12574 1.00000 S7 S 0.03168 0.12574 0.62456 1.00000 S8 S 0.46832 0.37544 0.87426 1.00000 S9 S 0.04718 0.79886 0.95398 1.00000 S10 S 0.45282 0.04602 0.20114 1.00000 S11 S 0.95282 0.20114 0.04602 1.00000 S12 S 0.54718 0.95398 0.79886 1.00000