# CIF generated by HEAS from Alexandria entry agm006255261 data_agm006255261 _cell_length_a 9.61376 _cell_length_b 9.61376 _cell_length_c 4.53919 _cell_angle_alpha 77.09664 _cell_angle_beta 77.09664 _cell_angle_gamma 24.18766 _cell_volume 167.35049 _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 0.68208 0.68208 0.81241 1.00000 Ca3 Ca 0.31792 0.31792 0.18759 1.00000 Cu1 Cu 0.43030 0.43030 0.62334 1.00000 Cu2 Cu 0.56970 0.56970 0.37666 1.00000 As1 As 0.84933 0.84933 0.63772 1.00000 As2 As 0.15067 0.15067 0.36228 1.00000 H1 H 0.43660 0.43660 0.99489 1.00000 H2 H 0.74970 0.25030 0.50000 1.00000 H3 H 0.25030 0.74970 0.50000 1.00000 H4 H 0.56340 0.56340 0.00511 1.00000