# CIF generated by HEAS from Alexandria entry agm005608596 data_agm005608596 _cell_length_a 11.24912 _cell_length_b 11.95847 _cell_length_c 11.95821 _cell_angle_alpha 119.01236 _cell_angle_beta 102.75621 _cell_angle_gamma 102.75790 _cell_volume 1266.60652 _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 Zr1 Zr 0.35059 0.12540 0.12541 1.00000 Zr2 Zr 0.64941 0.87460 0.87459 1.00000 Zr3 Zr 0.66169 0.06036 0.24887 1.00000 Zr4 Zr 0.33830 0.75112 0.93963 1.00000 Zr5 Zr 0.33831 0.93964 0.75113 1.00000 Zr6 Zr 0.66170 0.24888 0.06037 1.00000 Hg1 Hg 0.21954 0.56056 0.22790 1.00000 Hg2 Hg 0.78045 0.77212 0.43944 1.00000 Hg3 Hg 0.78046 0.43944 0.77210 1.00000 Hg4 Hg 0.21955 0.22788 0.56056 1.00000 I1 I 0.50000 0.19787 0.80214 1.00000 I2 I 0.17451 0.49874 0.87869 1.00000 I3 I 0.17451 0.87870 0.49874 1.00000 I4 I 0.82549 0.50126 0.12131 1.00000 I5 I 0.80263 0.74295 0.74296 1.00000 I6 I 0.19737 0.25705 0.25704 1.00000 I7 I 0.51032 0.39450 0.19629 1.00000 I8 I 0.48968 0.80371 0.60550 1.00000 I9 I 0.48968 0.60550 0.80371 1.00000 I10 I 0.51032 0.19629 0.39450 1.00000 I11 I 0.16227 0.67620 0.67619 1.00000 I12 I 0.82570 0.92606 0.12600 1.00000 I13 I 0.82571 0.12601 0.92607 1.00000 I14 I 0.17430 0.07394 0.87400 1.00000 I15 I 0.17429 0.87399 0.07393 1.00000 I16 I 0.50000 0.80213 0.19786 1.00000 I17 I 0.83773 0.32380 0.32381 1.00000 I18 I 0.82549 0.12130 0.50126 1.00000