# CIF generated by HEAS from Alexandria entry agm005495087 data_agm005495087 _cell_length_a 5.15364 _cell_length_b 5.15364 _cell_length_c 3.42471 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 105.25228 _cell_volume 87.75649 _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 0.50000 0.50000 0.00000 1.00000 Sc2 Sc 0.80516 0.19484 0.50000 1.00000 Sc3 Sc 0.19484 0.80516 0.50000 1.00000 C1 C 0.00000 0.00000 0.00000 1.00000 C2 C 0.00000 0.50000 0.00000 1.00000 C3 C 0.50000 0.00000 0.00000 1.00000 C4 C 0.26965 0.26965 0.50000 1.00000 C5 C 0.73035 0.73035 0.50000 1.00000