# CIF generated by HEAS from Alexandria entry agm005010398 data_agm005010398 _cell_length_a 5.30901 _cell_length_b 8.09509 _cell_length_c 7.40323 _cell_angle_alpha 111.18032 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 296.67559 _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 Cu1 Cu 0.25000 0.60646 0.43639 1.00000 Cu2 Cu 0.75000 0.39354 0.56361 1.00000 As1 As 0.25000 0.64021 0.93946 1.00000 As2 As 0.75000 0.35979 0.06054 1.00000 Se1 Se 0.75000 0.60225 0.37079 1.00000 Se2 Se 0.25000 0.39775 0.62921 1.00000 Se3 Se 0.75000 0.59343 0.88857 1.00000 Se4 Se 0.25000 0.40657 0.11143 1.00000 I1 I 0.25000 0.90171 0.72384 1.00000 I2 I 0.75000 0.09829 0.27616 1.00000