# CIF generated by HEAS from Alexandria entry agm003242579 data_agm003242579 _cell_length_a 4.21893 _cell_length_b 10.29283 _cell_length_c 17.92996 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 778.60445 _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 Ni1 Ni 0.49561 0.81440 0.96788 1.00000 Ni2 Ni 0.49561 0.18560 0.03212 1.00000 Ni3 Ni 0.50439 0.68560 0.46788 1.00000 Ni4 Ni 0.50439 0.31440 0.53212 1.00000 Ni5 Ni 0.99762 0.91050 0.90383 1.00000 Ni6 Ni 0.99762 0.08950 0.09617 1.00000 Ni7 Ni 0.00238 0.58950 0.40383 1.00000 Ni8 Ni 0.00238 0.41050 0.59617 1.00000 Ni9 Ni 0.99539 0.82681 0.05220 1.00000 Ni10 Ni 0.99539 0.17319 0.94780 1.00000 Ni11 Ni 0.00461 0.67319 0.55220 1.00000 Ni12 Ni 0.00461 0.32681 0.44780 1.00000 Ni13 Ni 0.49560 0.94175 0.10495 1.00000 Ni14 Ni 0.49560 0.05825 0.89505 1.00000 Ni15 Ni 0.50440 0.55825 0.60495 1.00000 Ni16 Ni 0.50440 0.44175 0.39505 1.00000 Bi1 Bi 0.49451 0.83310 0.81656 1.00000 Bi2 Bi 0.49451 0.16690 0.18344 1.00000 Bi3 Bi 0.50549 0.66690 0.31656 1.00000 Bi4 Bi 0.50549 0.33310 0.68344 1.00000 Bi5 Bi 0.49360 0.67852 0.09730 1.00000 Bi6 Bi 0.49360 0.32148 0.90270 1.00000 Bi7 Bi 0.50640 0.82148 0.59730 1.00000 Bi8 Bi 0.50640 0.17852 0.40270 1.00000 Bi9 Bi 0.99857 0.65330 0.93769 1.00000 Bi10 Bi 0.99857 0.34670 0.06231 1.00000 Bi11 Bi 0.00143 0.84670 0.43769 1.00000 Bi12 Bi 0.00143 0.15330 0.56231 1.00000 Bi13 Bi 0.99917 0.89630 0.19862 1.00000 Bi14 Bi 0.99917 0.10370 0.80138 1.00000 Bi15 Bi 0.00083 0.60370 0.69862 1.00000 Bi16 Bi 0.00083 0.39630 0.30138 1.00000 S1 S 0.74562 0.00000 0.00000 1.00000 S2 S 0.25438 0.50000 0.50000 1.00000