# CIF generated by HEAS from Alexandria entry agm001820331 data_agm001820331 _cell_length_a 14.59283 _cell_length_b 14.59283 _cell_length_c 14.59283 _cell_angle_alpha 109.47122 _cell_angle_beta 109.47122 _cell_angle_gamma 109.47122 _cell_volume 2392.19593 _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 Te1 Te 0.75000 0.37500 0.12500 1.00000 Te2 Te 0.87500 0.75000 0.12500 1.00000 Te3 Te 0.37500 0.75000 0.62500 1.00000 Te4 Te 0.25000 0.12500 0.37500 1.00000 Te5 Te 0.87500 0.12500 0.25000 1.00000 Te6 Te 0.37500 0.62500 0.25000 1.00000 Te7 Te 0.62500 0.37500 0.75000 1.00000 Te8 Te 0.12500 0.87500 0.75000 1.00000 Te9 Te 0.75000 0.87500 0.62500 1.00000 Te10 Te 0.62500 0.25000 0.37500 1.00000 Te11 Te 0.12500 0.25000 0.87500 1.00000 Te12 Te 0.25000 0.62500 0.87500 1.00000 As1 As 0.12500 0.37500 0.25000 1.00000 As2 As 0.00000 0.50000 0.00000 1.00000 As3 As 0.00000 0.00000 0.00000 1.00000 As4 As 0.37500 0.25000 0.12500 1.00000 As5 As 0.50000 0.00000 0.50000 1.00000 As6 As 0.50000 0.50000 0.00000 1.00000 As7 As 0.12500 0.75000 0.37500 1.00000 As8 As 0.75000 0.12500 0.87500 1.00000 As9 As 0.75000 0.62500 0.37500 1.00000 As10 As 0.37500 0.12500 0.75000 1.00000 As11 As 0.62500 0.87500 0.25000 1.00000 As12 As 0.50000 0.50000 0.50000 1.00000 As13 As 0.50000 0.00000 0.00000 1.00000 As14 As 0.00000 0.00000 0.50000 1.00000 As15 As 0.25000 0.37500 0.62500 1.00000 As16 As 0.25000 0.87500 0.12500 1.00000 As17 As 0.00000 0.50000 0.50000 1.00000 As18 As 0.87500 0.25000 0.62500 1.00000 As19 As 0.62500 0.75000 0.87500 1.00000 As20 As 0.87500 0.62500 0.75000 1.00000 Hg1 Hg 0.71687 0.10810 0.03660 1.00000 Hg2 Hg 0.31973 0.53660 0.42850 1.00000 Hg3 Hg 0.96340 0.39190 0.28313 1.00000 Hg4 Hg 0.53660 0.21687 0.10810 1.00000 Hg5 Hg 0.60877 0.71687 0.68027 1.00000 Hg6 Hg 0.96340 0.57150 0.18027 1.00000 Hg7 Hg 0.31973 0.78313 0.39123 1.00000 Hg8 Hg 0.07150 0.89123 0.10810 1.00000 Hg9 Hg 0.57150 0.96340 0.68027 1.00000 Hg10 Hg 0.71687 0.60877 0.18027 1.00000 Hg11 Hg 0.78313 0.46340 0.39190 1.00000 Hg12 Hg 0.81973 0.92850 0.03660 1.00000 Hg13 Hg 0.10810 0.71687 0.53660 1.00000 Hg14 Hg 0.39190 0.42850 0.10877 1.00000 Hg15 Hg 0.10877 0.92850 0.39190 1.00000 Hg16 Hg 0.39123 0.10810 0.57150 1.00000 Hg17 Hg 0.10877 0.18027 0.21687 1.00000 Hg18 Hg 0.46340 0.68027 0.07150 1.00000 Hg19 Hg 0.81973 0.89123 0.28313 1.00000 Hg20 Hg 0.10810 0.39123 0.07150 1.00000 Hg21 Hg 0.39190 0.96340 0.78313 1.00000 Hg22 Hg 0.57150 0.60810 0.39123 1.00000 Hg23 Hg 0.92850 0.81973 0.53660 1.00000 Hg24 Hg 0.78313 0.31973 0.89123 1.00000 Hg25 Hg 0.42850 0.39190 0.60877 1.00000 Hg26 Hg 0.07150 0.18027 0.46340 1.00000 Hg27 Hg 0.21687 0.68027 0.10877 1.00000 Hg28 Hg 0.18027 0.10877 0.71687 1.00000 Hg29 Hg 0.60810 0.03660 0.21687 1.00000 Hg30 Hg 0.89190 0.60877 0.92850 1.00000 Hg31 Hg 0.53660 0.31973 0.92850 1.00000 Hg32 Hg 0.60877 0.89190 0.42850 1.00000 Hg33 Hg 0.89123 0.81973 0.78313 1.00000 Hg34 Hg 0.89123 0.07150 0.60810 1.00000 Hg35 Hg 0.89190 0.28313 0.46340 1.00000 Hg36 Hg 0.18027 0.07150 0.96340 1.00000 Hg37 Hg 0.60810 0.57150 0.89123 1.00000 Hg38 Hg 0.42850 0.03660 0.31973 1.00000 Hg39 Hg 0.28313 0.39123 0.81973 1.00000 Hg40 Hg 0.21687 0.53660 0.60810 1.00000 Hg41 Hg 0.92850 0.10877 0.89190 1.00000 Hg42 Hg 0.68027 0.21687 0.60877 1.00000 Hg43 Hg 0.46340 0.78313 0.89190 1.00000 Hg44 Hg 0.03660 0.42850 0.81973 1.00000 Hg45 Hg 0.39123 0.28313 0.31973 1.00000 Hg46 Hg 0.03660 0.60810 0.71687 1.00000 Hg47 Hg 0.68027 0.46340 0.57150 1.00000 Hg48 Hg 0.28313 0.89190 0.96340 1.00000