# CIF generated by HEAS from Alexandria entry agm005643123 data_agm005643123 _cell_length_a 3.92669 _cell_length_b 5.57006 _cell_length_c 6.85913 _cell_angle_alpha 113.95586 _cell_angle_beta 106.63287 _cell_angle_gamma 90.00001 _cell_volume 130.20024 _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 Ca1 Ca 0.50000 0.50000 0.50000 1.00000 Y1 Y 0.83466 0.83466 0.16932 1.00000 Y2 Y 0.16534 0.16534 0.83068 1.00000 S1 S 0.83237 0.33237 0.16473 1.00000 S2 S 0.16763 0.66763 0.83527 1.00000 S3 S 0.50000 0.00000 0.50000 1.00000