# CIF generated by HEAS from Alexandria entry agm005697398 data_agm005697398 _cell_length_a 8.23502 _cell_length_b 9.10811 _cell_length_c 9.22340 _cell_angle_alpha 78.35697 _cell_angle_beta 63.48576 _cell_angle_gamma 63.12337 _cell_volume 552.17569 _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 0.87111 0.50000 0.25779 1.00000 Ca2 Ca 0.12111 1.00000 0.75779 1.00000 Ca3 Ca 0.87889 0.00000 0.24221 1.00000 Ca4 Ca 0.62889 0.50000 0.74221 1.00000 Ca5 Ca 0.38364 0.00000 0.23273 1.00000 Ca6 Ca 0.61636 1.00000 0.76727 1.00000 Ca7 Ca 0.36636 0.50000 0.26727 1.00000 Ca8 Ca 0.13364 0.50000 0.73273 1.00000 As1 As 0.36229 0.81195 0.00246 1.00000 As2 As 0.17670 0.18805 0.99754 1.00000 As3 As 0.82576 0.81195 0.99754 1.00000 As4 As 0.63525 0.18805 0.00246 1.00000 As5 As 0.38771 0.68805 0.49754 1.00000 As6 As 0.57330 0.31195 0.50246 1.00000 As7 As 0.92424 0.68805 0.50246 1.00000 As8 As 0.44265 0.11469 0.50000 1.00000 As9 As 0.69265 0.61469 0.00000 1.00000 As10 As 0.30735 0.38531 1.00000 1.00000 As11 As 0.05735 0.88531 0.50000 1.00000 As12 As 0.11475 0.31195 0.49754 1.00000 Pd1 Pd 0.59342 0.81316 0.50000 1.00000 Pd2 Pd 0.15658 0.68684 1.00000 1.00000 Pd3 Pd 0.90658 0.18684 0.50000 1.00000 Pd4 Pd 0.84342 0.31316 0.00000 1.00000