# CIF generated by HEAS from Alexandria entry agm005963786 data_agm005963786 _cell_length_a 4.36861 _cell_length_b 6.43266 _cell_length_c 7.84388 _cell_angle_alpha 114.20757 _cell_angle_beta 106.16906 _cell_angle_gamma 90.00000 _cell_volume 191.44377 _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 0.35593 0.85593 0.71185 1.00000 Ca2 Ca 0.64407 0.14407 0.28815 1.00000 As1 As 0.00000 0.00000 0.00000 1.00000 I1 I 0.67595 0.67595 0.35189 1.00000 I2 I 0.32405 0.32405 0.64811 1.00000