The compound described by Lu(PO3)3 crystallizes in the monoclinic Cc space group. Lu(1) is bonded to one O(1), one O(5), one O(6), one O(7), one O(8), and one O(9) atom to form LuO6 octahedra that share corners with two equivalent P(1)O4 tetrahedra, corners with two equivalent P(2)O4 tetrahedra, and corners with two equivalent P(3)O4 tetrahedra. There are three inequivalent P sites. In the first P site, P(1) is bonded to one O(2), one O(3), one O(5), and one O(7) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-29°. In the second P site, P(2) is bonded to one O(1), one O(2), one O(4), and one O(6) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-32°. In the third P site, P(3) is bonded to one O(3), one O(4), one O(8), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-37°. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(2) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one P(1) and one P(2) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one P(1) and one P(3) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one P(2) and one P(3) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(1) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(2) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(1) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Lu(PO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.724
_cell_length_b   7.724
_cell_length_c   9.894
_cell_angle_alpha   56.906
_cell_angle_beta   56.906
_cell_angle_gamma   51.154
_symmetry_Int_Tables_number   1
_cell_volume   365.927
_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
  Lu  Lu0  1  0.607  0.137  0.355  1.0
  Lu  Lu1  1  0.137  0.607  0.855  1.0
  P  P2  1  0.555  0.704  0.084  1.0
  P  P3  1  0.109  0.932  0.023  1.0
  P  P4  1  0.932  0.109  0.523  1.0
  P  P5  1  0.118  0.326  0.689  1.0
  P  P6  1  0.704  0.555  0.584  1.0
  P  P7  1  0.326  0.118  0.189  1.0
  O  O8  1  0.959  0.993  0.183  1.0
  O  O9  1  0.372  0.860  0.983  1.0
  O  O10  1  0.875  0.508  0.655  1.0
  O  O11  1  0.165  0.038  0.372  1.0
  O  O12  1  0.789  0.648  0.956  1.0
  O  O13  1  0.993  0.959  0.683  1.0
  O  O14  1  0.106  0.755  0.006  1.0
  O  O15  1  0.755  0.106  0.506  1.0
  O  O16  1  0.511  0.508  0.229  1.0
  O  O17  1  0.508  0.875  0.155  1.0
  O  O18  1  0.860  0.372  0.483  1.0
  O  O19  1  0.283  0.194  0.565  1.0
  O  O20  1  0.196  0.452  0.698  1.0
  O  O21  1  0.648  0.789  0.456  1.0
  O  O22  1  0.508  0.511  0.729  1.0
  O  O23  1  0.038  0.165  0.872  1.0
  O  O24  1  0.452  0.196  0.198  1.0
  O  O25  1  0.194  0.283  0.065  1.0
[/CIF]
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The compound described by Lu(PO3)3 crystallizes in the monoclinic Cc space group. Lu(1) is bonded to one O(1), one O(5), one O(6), one O(7), one O(8), and one O(9) atom to form LuO6 octahedra that share corners with two equivalent P(1)O4 tetrahedra, corners with two equivalent P(2)O4 tetrahedra, and corners with two equivalent P(3)O4 tetrahedra. There are three inequivalent P sites. In the first P site, P(1) is bonded to one O(2), one O(3), one O(5), and one O(7) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-29°. In the second P site, P(2) is bonded to one O(1), one O(2), one O(4), and one O(6) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(3)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 28-32°. In the third P site, P(3) is bonded to one O(3), one O(4), one O(8), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent Lu(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, and  a cornercorner with one P(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-37°. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(2) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one P(1) and one P(2) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one P(1) and one P(3) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one P(2) and one P(3) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(1) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(2) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(1) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one Lu(1) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Lu(PO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.724
_cell_length_b   7.724
_cell_length_c   9.894
_cell_angle_alpha   56.906
_cell_angle_beta   56.906
_cell_angle_gamma   51.154
_symmetry_Int_Tables_number   1
_cell_volume   365.927
_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
  Lu  Lu0  1  0.607  0.137  0.355  1.0
  Lu  Lu1  1  0.137  0.607  0.855  1.0
  P  P2  1  0.555  0.704  0.084  1.0
  P  P3  1  0.109  0.932  0.023  1.0
  P  P4  1  0.932  0.109  0.523  1.0
  P  P5  1  0.118  0.326  0.689  1.0
  P  P6  1  0.704  0.555  0.584  1.0
  P  P7  1  0.326  0.118  0.189  1.0
  O  O8  1  0.959  0.993  0.183  1.0
  O  O9  1  0.372  0.860  0.983  1.0
  O  O10  1  0.875  0.508  0.655  1.0
  O  O11  1  0.165  0.038  0.372  1.0
  O  O12  1  0.789  0.648  0.956  1.0
  O  O13  1  0.993  0.959  0.683  1.0
  O  O14  1  0.106  0.755  0.006  1.0
  O  O15  1  0.755  0.106  0.506  1.0
  O  O16  1  0.511  0.508  0.229  1.0
  O  O17  1  0.508  0.875  0.155  1.0
  O  O18  1  0.860  0.372  0.483  1.0
  O  O19  1  0.283  0.194  0.565  1.0
  O  O20  1  0.196  0.452  0.698  1.0
  O  O21  1  0.648  0.789  0.456  1.0
  O  O22  1  0.508  0.511  0.729  1.0
  O  O23  1  0.038  0.165  0.872  1.0
  O  O24  1  0.452  0.196  0.198  1.0
  O  O25  1  0.194  0.283  0.065  1.0
[/CIF]
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