The structure described by PuO3Tl is High-temperature superconductor-derived structured and crystallizes in the orthorhombic Pnma space group. The structure consists of four 7440-28-0 atoms inside a PuO3 framework. In the PuO3 framework, Pu(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing PuO6 octahedra. The corner-sharing octahedral tilt angles are 1°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to two equivalent Pu(1) atoms. In the second O site, O(2) is bonded in a linear geometry to two equivalent Pu(1) atoms. is represented by the CIF file [CIF]
data_PuTlO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.329
_cell_length_b   6.131
_cell_length_c   6.132
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   162.728
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  O  O0  1  0.500  1.000  0.500  1.0
  O  O1  1  0.500  0.500  0.000  1.0
  O  O2  1  0.000  0.736  0.235  1.0
  O  O3  1  0.000  0.764  0.735  1.0
  O  O4  1  0.000  0.236  0.265  1.0
  O  O5  1  0.000  0.264  0.765  1.0
  Pu  Pu6  1  1.000  0.000  0.500  1.0
  Pu  Pu7  1  0.000  0.500  1.000  1.0
  Tl  Tl8  1  0.500  0.000  0.000  1.0
  Tl  Tl9  1  0.500  0.500  0.500  1.0
[/CIF]
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The structure described by PuO3Tl is High-temperature superconductor-derived structured and crystallizes in the orthorhombic Pnma space group. The structure consists of four 7440-28-0 atoms inside a PuO3 framework. In the PuO3 framework, Pu(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing PuO6 octahedra. The corner-sharing octahedral tilt angles are 1°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to two equivalent Pu(1) atoms. In the second O site, O(2) is bonded in a linear geometry to two equivalent Pu(1) atoms. is represented by the CIF file [CIF]
data_PuTlO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.329
_cell_length_b   6.131
_cell_length_c   6.132
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   162.728
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  O  O0  1  0.500  1.000  0.500  1.0
  O  O1  1  0.500  0.500  0.000  1.0
  O  O2  1  0.000  0.736  0.235  1.0
  O  O3  1  0.000  0.764  0.735  1.0
  O  O4  1  0.000  0.236  0.265  1.0
  O  O5  1  0.000  0.264  0.765  1.0
  Pu  Pu6  1  1.000  0.000  0.500  1.0
  Pu  Pu7  1  0.000  0.500  1.000  1.0
  Tl  Tl8  1  0.500  0.000  0.000  1.0
  Tl  Tl9  1  0.500  0.500  0.500  1.0
[/CIF]
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