The material described by Th7Os3 crystallizes in the hexagonal P6_3mc space group. There are three inequivalent Th sites. In the first Th site, Th(1) is bonded in a distorted water-like geometry to four equivalent Os(1) atoms. In the second Th site, Th(2) is bonded in a 3-coordinate geometry to four equivalent Os(1) atoms. In the third Th site, Th(3) is bonded in a 3-coordinate geometry to three equivalent Os(1) atoms. Os(1) is bonded in a 9-coordinate geometry to one Th(3), four equivalent Th(1), and four equivalent Th(2) atoms. is represented by the CIF file [CIF]
data_Th7Os3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.005
_cell_length_b   10.005
_cell_length_c   6.381
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   553.085
_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
  Th  Th0  1  0.461  0.539  0.302  1.0
  Th  Th1  1  0.078  0.539  0.302  1.0
  Th  Th2  1  0.922  0.461  0.802  1.0
  Th  Th3  1  0.252  0.126  0.505  1.0
  Th  Th4  1  0.539  0.078  0.802  1.0
  Th  Th5  1  0.748  0.874  0.005  1.0
  Th  Th6  1  0.667  0.333  0.280  1.0
  Th  Th7  1  0.126  0.874  0.005  1.0
  Th  Th8  1  0.461  0.922  0.302  1.0
  Th  Th9  1  0.539  0.461  0.802  1.0
  Th  Th10  1  0.874  0.126  0.505  1.0
  Th  Th11  1  0.126  0.252  0.005  1.0
  Th  Th12  1  0.874  0.748  0.505  1.0
  Th  Th13  1  0.333  0.667  0.780  1.0
  Os  Os14  1  0.813  0.627  0.047  1.0
  Os  Os15  1  0.813  0.187  0.047  1.0
  Os  Os16  1  0.627  0.813  0.547  1.0
  Os  Os17  1  0.373  0.187  0.047  1.0
  Os  Os18  1  0.187  0.373  0.547  1.0
  Os  Os19  1  0.187  0.813  0.547  1.0
[/CIF]
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The material described by Th7Os3 crystallizes in the hexagonal P6_3mc space group. There are three inequivalent Th sites. In the first Th site, Th(1) is bonded in a distorted water-like geometry to four equivalent Os(1) atoms. In the second Th site, Th(2) is bonded in a 3-coordinate geometry to four equivalent Os(1) atoms. In the third Th site, Th(3) is bonded in a 3-coordinate geometry to three equivalent Os(1) atoms. Os(1) is bonded in a 9-coordinate geometry to one Th(3), four equivalent Th(1), and four equivalent Th(2) atoms. is represented by the CIF file [CIF]
data_Th7Os3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.005
_cell_length_b   10.005
_cell_length_c   6.381
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   553.085
_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
  Th  Th0  1  0.461  0.539  0.302  1.0
  Th  Th1  1  0.078  0.539  0.302  1.0
  Th  Th2  1  0.922  0.461  0.802  1.0
  Th  Th3  1  0.252  0.126  0.505  1.0
  Th  Th4  1  0.539  0.078  0.802  1.0
  Th  Th5  1  0.748  0.874  0.005  1.0
  Th  Th6  1  0.667  0.333  0.280  1.0
  Th  Th7  1  0.126  0.874  0.005  1.0
  Th  Th8  1  0.461  0.922  0.302  1.0
  Th  Th9  1  0.539  0.461  0.802  1.0
  Th  Th10  1  0.874  0.126  0.505  1.0
  Th  Th11  1  0.126  0.252  0.005  1.0
  Th  Th12  1  0.874  0.748  0.505  1.0
  Th  Th13  1  0.333  0.667  0.780  1.0
  Os  Os14  1  0.813  0.627  0.047  1.0
  Os  Os15  1  0.813  0.187  0.047  1.0
  Os  Os16  1  0.627  0.813  0.547  1.0
  Os  Os17  1  0.373  0.187  0.047  1.0
  Os  Os18  1  0.187  0.373  0.547  1.0
  Os  Os19  1  0.187  0.813  0.547  1.0
[/CIF]
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