# CIF generated by HEAS from Alexandria entry agm044017476 data_agm044017476 _cell_length_a 8.07711 _cell_length_b 8.07711 _cell_length_c 8.04534 _cell_angle_alpha 80.35516 _cell_angle_beta 99.64484 _cell_angle_gamma 60.01185 _cell_volume 428.33794 _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 0.40677 0.93079 0.20733 1.00000 Ca2 Ca 0.26835 0.73165 0.79276 1.00000 Ca3 Ca 0.59323 0.06921 0.79267 1.00000 Ca4 Ca 0.06921 0.59323 0.20733 1.00000 Ca5 Ca 0.73165 0.26835 0.20724 1.00000 Ca6 Ca 0.93079 0.40677 0.79267 1.00000 Bi1 Bi 0.00000 0.00000 0.00000 1.00000 Sb1 Sb 0.33339 0.33339 0.00000 1.00000 Sb2 Sb 0.66661 0.66661 0.00000 1.00000 I1 I 0.16749 0.16749 0.50000 1.00000 I2 I 0.83251 0.83251 0.50000 1.00000 I3 I 0.50000 0.50000 0.50000 1.00000