# CIF generated by HEAS from Alexandria entry agm005706359 data_agm005706359 _cell_length_a 8.36571 _cell_length_b 8.36571 _cell_length_c 8.89644 _cell_angle_alpha 61.95446 _cell_angle_beta 61.95447 _cell_angle_gamma 60.00001 _cell_volume 452.81830 _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 0.00000 0.00000 0.00000 1.00000 Ca2 Ca 0.35422 0.35422 0.93733 1.00000 Ca3 Ca 0.50000 0.50000 0.50000 1.00000 Ca4 Ca 0.64578 0.64578 0.06267 1.00000 Pa1 Pa 0.50000 0.00000 0.50000 1.00000 Pa2 Pa 0.00000 0.00000 0.50000 1.00000 Pa3 Pa 0.00000 0.50000 0.50000 1.00000 As1 As 0.22962 0.22962 0.31115 1.00000 As2 As 0.22342 0.74826 0.28007 1.00000 As3 As 0.74826 0.74826 0.28007 1.00000 As4 As 0.74826 0.22342 0.28007 1.00000 As5 As 0.77038 0.77038 0.68885 1.00000 As6 As 0.77658 0.25174 0.71993 1.00000 As7 As 0.25174 0.25174 0.71993 1.00000 As8 As 0.25174 0.77658 0.71993 1.00000