# CIF generated by HEAS from Alexandria entry agm005220039 data_agm005220039 _cell_length_a 14.19911 _cell_length_b 14.19911 _cell_length_c 14.19911 _cell_angle_alpha 60.00000 _cell_angle_beta 60.00000 _cell_angle_gamma 60.00000 _cell_volume 2024.26970 _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 Ta1 Ta 0.35699 0.35699 0.14301 1.00000 Ta2 Ta 0.14301 0.35699 0.14301 1.00000 Ta3 Ta 0.14301 0.35699 0.35699 1.00000 Ta4 Ta 0.89301 0.89301 0.10699 1.00000 Ta5 Ta 0.10699 0.89301 0.10699 1.00000 Ta6 Ta 0.10699 0.89301 0.89301 1.00000 Ta7 Ta 0.14301 0.14301 0.35699 1.00000 Ta8 Ta 0.35699 0.14301 0.14301 1.00000 Ta9 Ta 0.10699 0.10699 0.89301 1.00000 Ta10 Ta 0.89301 0.10699 0.10699 1.00000 Ta11 Ta 0.35699 0.14301 0.35699 1.00000 Ta12 Ta 0.89301 0.10699 0.89301 1.00000 C1 C 0.46560 0.46560 0.03440 1.00000 C2 C 0.03440 0.46560 0.03440 1.00000 C3 C 0.03440 0.46560 0.46560 1.00000 C4 C 0.78440 0.78440 0.21560 1.00000 C5 C 0.21560 0.78440 0.21560 1.00000 C6 C 0.21560 0.78440 0.78440 1.00000 C7 C 0.03440 0.03440 0.46560 1.00000 C8 C 0.46560 0.03440 0.03440 1.00000 C9 C 0.21560 0.21560 0.78440 1.00000 C10 C 0.78440 0.21560 0.21560 1.00000 C11 C 0.46560 0.03440 0.46560 1.00000 C12 C 0.78440 0.21560 0.78440 1.00000 N1 N 0.52407 0.52407 0.97593 1.00000 N2 N 0.97593 0.52407 0.97593 1.00000 N3 N 0.97593 0.52407 0.52407 1.00000 N4 N 0.72593 0.72593 0.27407 1.00000 N5 N 0.27407 0.72593 0.27407 1.00000 N6 N 0.27407 0.72593 0.72593 1.00000 N7 N 0.97593 0.97593 0.52407 1.00000 N8 N 0.52407 0.97593 0.97593 1.00000 N9 N 0.27407 0.27407 0.72593 1.00000 N10 N 0.72593 0.27407 0.27407 1.00000 N11 N 0.52407 0.97593 0.52407 1.00000 N12 N 0.72593 0.27407 0.72593 1.00000 Cl1 Cl 0.25108 0.49038 0.00747 1.00000 Cl2 Cl 0.00747 0.49038 0.25107 1.00000 Cl3 Cl 0.25107 0.49038 0.25108 1.00000 Cl4 Cl 0.99892 0.75962 0.99893 1.00000 Cl5 Cl 0.99893 0.75962 0.24253 1.00000 Cl6 Cl 0.24253 0.75962 0.99892 1.00000 Cl7 Cl 0.00747 0.25107 0.25108 1.00000 Cl8 Cl 0.25107 0.25108 0.00747 1.00000 Cl9 Cl 0.25108 0.00747 0.25107 1.00000 Cl10 Cl 0.99893 0.24253 0.99892 1.00000 Cl11 Cl 0.24253 0.99892 0.99893 1.00000 Cl12 Cl 0.99892 0.99893 0.24253 1.00000 Cl13 Cl 0.25107 0.00747 0.49038 1.00000 Cl14 Cl 0.25108 0.25107 0.49038 1.00000 Cl15 Cl 0.00747 0.25108 0.49038 1.00000 Cl16 Cl 0.24253 0.99893 0.75962 1.00000 Cl17 Cl 0.99892 0.24253 0.75962 1.00000 Cl18 Cl 0.99893 0.99892 0.75962 1.00000 Cl19 Cl 0.49038 0.25108 0.25107 1.00000 Cl20 Cl 0.49038 0.00747 0.25108 1.00000 Cl21 Cl 0.49038 0.25107 0.00747 1.00000 Cl22 Cl 0.75962 0.99892 0.24253 1.00000 Cl23 Cl 0.75962 0.99893 0.99892 1.00000 Cl24 Cl 0.75962 0.24253 0.99893 1.00000 O1 O 0.54502 0.79599 0.77371 1.00000 O2 O 0.77371 0.79599 0.88528 1.00000 O3 O 0.88528 0.79599 0.54502 1.00000 O4 O 0.70498 0.45401 0.36472 1.00000 O5 O 0.36472 0.45401 0.47629 1.00000 O6 O 0.47629 0.45401 0.70498 1.00000 O7 O 0.77371 0.88528 0.54502 1.00000 O8 O 0.88528 0.54502 0.77371 1.00000 O9 O 0.54502 0.77371 0.88528 1.00000 O10 O 0.36472 0.47629 0.70498 1.00000 O11 O 0.47629 0.70498 0.36472 1.00000 O12 O 0.70498 0.36472 0.47629 1.00000 O13 O 0.88528 0.77371 0.79599 1.00000 O14 O 0.54502 0.88528 0.79599 1.00000 O15 O 0.77371 0.54502 0.79599 1.00000 O16 O 0.47629 0.36472 0.45401 1.00000 O17 O 0.70498 0.47629 0.45401 1.00000 O18 O 0.36472 0.70498 0.45401 1.00000 O19 O 0.79599 0.54502 0.88528 1.00000 O20 O 0.79599 0.77371 0.54502 1.00000 O21 O 0.79599 0.88528 0.77371 1.00000 O22 O 0.45401 0.70498 0.47629 1.00000 O23 O 0.45401 0.36472 0.70498 1.00000 O24 O 0.45401 0.47629 0.36472 1.00000