# CIF generated by HEAS from Alexandria entry agm004682425 data_agm004682425 _cell_length_a 7.29604 _cell_length_b 7.29565 _cell_length_c 7.31969 _cell_angle_alpha 119.88385 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00175 _cell_volume 275.97980 _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 0.25278 0.50556 0.25830 1.00000 Sc2 Sc 0.74722 0.49444 0.74170 1.00000 Sc3 Sc 0.77047 0.54095 0.27391 1.00000 Sc4 Sc 0.22953 0.45905 0.72609 1.00000 Sc5 Sc 0.77043 0.00341 0.27386 1.00000 Sc6 Sc 0.22957 0.99659 0.72614 1.00000 Sc7 Sc 0.23298 0.00341 0.27386 1.00000 Sc8 Sc 0.76702 0.99659 0.72614 1.00000 P1 P 0.50000 0.00000 0.50000 1.00000 P2 P 0.50000 0.50000 0.50000 1.00000 P3 P 0.00000 0.50000 0.50000 1.00000 S1 S 0.00000 0.00000 0.00000 1.00000 S2 S 0.00000 0.50000 0.00000 1.00000 S3 S 0.50000 0.50000 0.00000 1.00000 O1 O 0.00000 0.00000 0.50000 1.00000