The structure described by PmS2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. Pm(1) is bonded in a 12-coordinate geometry to twelve equivalent S(1) atoms. S(1) is bonded to six equivalent Pm(1) and six equivalent S(1) atoms to form a mixture of distorted corner, edge, and face-sharing SPm6S6 cuboctahedra. is represented by the CIF card [CIF]
data_PmS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.574
_cell_length_b   5.575
_cell_length_c   5.580
_cell_angle_alpha   60.034
_cell_angle_beta   60.031
_cell_angle_gamma   60.006
_symmetry_Int_Tables_number   1
_cell_volume   122.676
_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
  Pm  Pm0  1  0.750  0.750  0.750  1.0
  Pm  Pm1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.875  0.375  0.375  1.0
  S  S3  1  0.375  0.875  0.375  1.0
  S  S4  1  0.375  0.375  0.875  1.0
  S  S5  1  0.375  0.375  0.375  1.0
[/CIF]
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The structure described by PmS2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. Pm(1) is bonded in a 12-coordinate geometry to twelve equivalent S(1) atoms. S(1) is bonded to six equivalent Pm(1) and six equivalent S(1) atoms to form a mixture of distorted corner, edge, and face-sharing SPm6S6 cuboctahedra. is represented by the CIF card [CIF]
data_PmS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.574
_cell_length_b   5.575
_cell_length_c   5.580
_cell_angle_alpha   60.034
_cell_angle_beta   60.031
_cell_angle_gamma   60.006
_symmetry_Int_Tables_number   1
_cell_volume   122.676
_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
  Pm  Pm0  1  0.750  0.750  0.750  1.0
  Pm  Pm1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.875  0.375  0.375  1.0
  S  S3  1  0.375  0.875  0.375  1.0
  S  S4  1  0.375  0.375  0.875  1.0
  S  S5  1  0.375  0.375  0.375  1.0
[/CIF]
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