data_image0 _chemical_formula_structural I16Zr4 _chemical_formula_sum "I16 Zr4" _cell_length_a 7.8741491492674305 _cell_length_b 8.016005640235665 _cell_length_c 16.730222862149596 _cell_angle_alpha 90.08644093078391 _cell_angle_beta 94.4002544248185 _cell_angle_gamma 90.94074375967467 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy I I1 1.0 0.8218875907999998 0.0849525067 0.060874415 1.0000 I I2 1.0 0.9346068683999998 0.595657045 0.1056032534 1.0000 I I3 1.0 0.4431950076999999 0.7237059448000001 0.1314268464 1.0000 I I4 1.0 0.3145313726999999 0.215547907 0.1365886052 1.0000 I I5 1.0 0.06570577599999998 0.9416611269 0.27365251539999996 1.0000 I I6 1.0 0.6744641384999999 0.3531460987 0.299667543 1.0000 I I7 1.0 0.5307033416 0.8923392699 0.3819073493 1.0000 I I8 1.0 0.21654063019999994 0.3502878117 0.40866514489999994 1.0000 I I9 1.0 0.7834580961999998 0.6497113057 0.5913348992 1.0000 I I10 1.0 0.46929793989999996 0.1076611154 0.6180927275 1.0000 I I11 1.0 0.3255358104 0.6468542679000001 0.7003319169 1.0000 I I12 1.0 0.9342930208999999 0.0583392466 0.7263481252 1.0000 I I13 1.0 0.6854686261 0.7844512204999999 0.8634114565 1.0000 I I14 1.0 0.5568049808 0.27629193510000005 0.8685732178999999 1.0000 I I15 1.0 0.06539313039999999 0.4043420824999999 0.8943968082999999 1.0000 I I16 1.0 0.17811246829999994 0.9150466294 0.9391262459999999 1.0000 Zr Zr1 1.0 0.1354589289 0.8757596632 0.10893092469999999 1.0000 Zr Zr2 1.0 0.3851167307999999 0.1613144522 0.30725331199999995 1.0000 Zr Zr3 1.0 0.6148845610999999 0.8386871808000002 0.6927467622999999 1.0000 Zr Zr4 1.0 0.8645410801999999 0.12424071189999998 0.8910691343999999 1.0000