The crystal structure described by LiCrPO5 crystallizes in the triclinic P1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(10), one O(2), one O(4), one O(6), and one O(9) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(4)O6 octahedra,  a faceface with one Cr(1)O6 octahedra, and  a faceface with one Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 59-63°. In the second Li site, Li(2) is bonded to one O(12), one O(16), one O(17), one O(19), one O(20), and one O(8) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(3)O6 octahedra,  a faceface with one Cr(2)O6 octahedra, and  a faceface with one Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 61-65°. In the third Li site, Li(3) is bonded to one O(11), one O(16), one O(18), one O(19), one O(20), and one O(8) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(2)O6 octahedra,  a faceface with one Cr(2)O6 octahedra, and  a faceface with one Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 62-65°. In the fourth Li site, Li(4) is bonded to one O(10), one O(3), one O(4), one O(6), one O(7), and one O(9) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(1)O6 octahedra,  a faceface with one Cr(1)O6 octahedra, and  a faceface with one Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 59-61°. There are four inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to one O(10), one O(13), one O(16), one O(2), one O(3), and one O(6) atom to form CrO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra, corners with two equivalent Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra, corners with two equivalent P(4)O4 tetrahedra,  a faceface with one Li(1)O6 octahedra, and  a faceface with one Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-65°. In the second Cr site, Cr(2) is bonded to one O(15), one O(17), one O(18), one O(19), one O(4), and one O(8) atom to form CrO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra, corners with two equivalent Cr(4)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  a faceface with one Li(2)O6 octahedra, and  a faceface with one Li(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-63°. In the third Cr site, Cr(3) is bonded to one O(11), one O(12), one O(14), one O(16), one O(20), and one O(6) atom to form distorted CrO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra, corners with two equivalent Cr(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra, corners with two equivalent P(2)O4 tetrahedra,  a faceface with one Li(2)O6 octahedra, and  a faceface with one Li(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-59°. In the fourth Cr site, Cr(4) is bonded to one O(1), one O(4), one O(5), one O(7), one O(8), and one O(9) atom to form CrO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra, corners with two equivalent Cr(2)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, corners with two equivalent P(1)O4 tetrahedra,  a faceface with one Li(1)O6 octahedra, and  a faceface with one Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-62°. There are four inequivalent P sites. In the first P site, P(1) is bonded to one O(1), one O(13), one O(20), and one O(7) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra, and corners with two equivalent Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-57°. In the second P site, P(2) is bonded to one O(11), one O(12), one O(15), and one O(9) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra, and corners with two equivalent Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-57°. In the third P site, P(3) is bonded to one O(10), one O(14), one O(17), and one O(18) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra, and corners with two equivalent Cr(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-58°. In the fourth P site, P(4) is bonded to one O(19), one O(2), one O(3), and one O(5) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra, and corners with two equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-57°. There are twenty inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one Cr(4), and one P(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Li(1), one Cr(1), and one P(4) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(4), one Cr(1), and one P(4) atom. In the fourth O site, O(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Li(4), one Cr(2), and one Cr(4) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one Cr(4) and one P(4) atom. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(1), and one Cr(3) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Li(4), one Cr(4), and one P(1) atom. In the eighth O site, O(8) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(3), one Cr(2), and one Cr(4) atom. In the ninth O site, O(9) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(4), and one P(2) atom. In the tenth O site, O(10) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(1), and one P(3) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Li(3), one Cr(3), and one P(2) atom. In the twelfth O site, O(12) is bonded in a 3-coordinate geometry to one Li(2), one Cr(3), and one P(2) atom. In the thirteenth O site, O(13) is bonded in a bent 150 degrees geometry to one Cr(1) and one P(1) atom. In the fourteenth O site, O(14) is bonded in a bent 150 degrees geometry to one Cr(3) and one P(3) atom. In the fifteenth O site, O(15) is bonded in a bent 150 degrees geometry to one Cr(2) and one P(2) atom. In the sixteenth O site, O(16) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(3), one Cr(1), and one Cr(3) atom. In the seventeenth O site, O(17) is bonded in a 3-coordinate geometry to one Li(2), one Cr(2), and one P(3) atom. In the eighteenth O site, O(18) is bonded in a 3-coordinate geometry to one Li(3), one Cr(2), and one P(3) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Cr(2), and one P(4) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Cr(3), and one P(1) atom. is represented by the CIF card [CIF]
data_LiCrPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.130
_cell_length_b   6.399
_cell_length_c   7.445
_cell_angle_alpha   90.014
_cell_angle_beta   90.144
_cell_angle_gamma   89.972
_symmetry_Int_Tables_number   1
_cell_volume   339.691
_cell_formula_units_Z   4
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
  Li  Li0  1  0.999  0.002  1.000  1.0
  Li  Li1  1  0.499  0.500  0.500  1.0
  Li  Li2  1  0.499  0.999  0.499  1.0
  Li  Li3  1  0.998  0.497  0.999  1.0
  Cr  Cr4  1  0.862  0.750  0.269  1.0
  Cr  Cr5  1  0.638  0.249  0.771  1.0
  Cr  Cr6  1  0.366  0.750  0.227  1.0
  Cr  Cr7  1  0.140  0.249  0.730  1.0
  P  P8  1  0.125  0.750  0.627  1.0
  P  P9  1  0.372  0.250  0.125  1.0
  P  P10  1  0.630  0.750  0.873  1.0
  P  P11  1  0.874  0.250  0.374  1.0
  O  O12  1  0.131  0.942  0.756  1.0
  O  O13  1  0.871  0.059  0.246  1.0
  O  O14  1  0.871  0.441  0.246  1.0
  O  O15  1  0.888  0.254  0.818  1.0
  O  O16  1  0.056  0.249  0.486  1.0
  O  O17  1  0.130  0.750  0.179  1.0
  O  O18  1  0.131  0.558  0.755  1.0
  O  O19  1  0.390  0.253  0.676  1.0
  O  O20  1  0.195  0.250  0.003  1.0
  O  O21  1  0.806  0.750  0.996  1.0
  O  O22  1  0.371  0.059  0.253  1.0
  O  O23  1  0.371  0.441  0.252  1.0
  O  O24  1  0.943  0.750  0.517  1.0
  O  O25  1  0.449  0.750  0.991  1.0
  O  O26  1  0.553  0.249  0.011  1.0
  O  O27  1  0.591  0.750  0.323  1.0
  O  O28  1  0.627  0.558  0.748  1.0
  O  O29  1  0.627  0.941  0.748  1.0
  O  O30  1  0.695  0.249  0.496  1.0
  O  O31  1  0.303  0.750  0.505  1.0
[/CIF]
.
The crystal structure described by LiCrPO5 crystallizes in the triclinic P1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(10), one O(2), one O(4), one O(6), and one O(9) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(4)O6 octahedra,  a faceface with one Cr(1)O6 octahedra, and  a faceface with one Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 59-63°. In the second Li site, Li(2) is bonded to one O(12), one O(16), one O(17), one O(19), one O(20), and one O(8) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(3)O6 octahedra,  a faceface with one Cr(2)O6 octahedra, and  a faceface with one Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 61-65°. In the third Li site, Li(3) is bonded to one O(11), one O(16), one O(18), one O(19), one O(20), and one O(8) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(2)O6 octahedra,  a faceface with one Cr(2)O6 octahedra, and  a faceface with one Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 62-65°. In the fourth Li site, Li(4) is bonded to one O(10), one O(3), one O(4), one O(6), one O(7), and one O(9) atom to form distorted LiO6 octahedra that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, edges with two equivalent Li(1)O6 octahedra,  a faceface with one Cr(1)O6 octahedra, and  a faceface with one Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 59-61°. There are four inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to one O(10), one O(13), one O(16), one O(2), one O(3), and one O(6) atom to form CrO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra, corners with two equivalent Cr(3)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra, corners with two equivalent P(4)O4 tetrahedra,  a faceface with one Li(1)O6 octahedra, and  a faceface with one Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-65°. In the second Cr site, Cr(2) is bonded to one O(15), one O(17), one O(18), one O(19), one O(4), and one O(8) atom to form CrO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra, corners with two equivalent Cr(4)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  a faceface with one Li(2)O6 octahedra, and  a faceface with one Li(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-63°. In the third Cr site, Cr(3) is bonded to one O(11), one O(12), one O(14), one O(16), one O(20), and one O(6) atom to form distorted CrO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra, corners with two equivalent Cr(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(3)O4 tetrahedra, corners with two equivalent P(2)O4 tetrahedra,  a faceface with one Li(2)O6 octahedra, and  a faceface with one Li(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-59°. In the fourth Cr site, Cr(4) is bonded to one O(1), one O(4), one O(5), one O(7), one O(8), and one O(9) atom to form CrO6 octahedra that share  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra, corners with two equivalent Cr(2)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra,  a cornercorner with one P(4)O4 tetrahedra, corners with two equivalent P(1)O4 tetrahedra,  a faceface with one Li(1)O6 octahedra, and  a faceface with one Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-62°. There are four inequivalent P sites. In the first P site, P(1) is bonded to one O(1), one O(13), one O(20), and one O(7) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra, and corners with two equivalent Cr(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-57°. In the second P site, P(2) is bonded to one O(11), one O(12), one O(15), and one O(9) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra, and corners with two equivalent Cr(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-57°. In the third P site, P(3) is bonded to one O(10), one O(14), one O(17), and one O(18) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(3)O6 octahedra, and corners with two equivalent Cr(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-58°. In the fourth P site, P(4) is bonded to one O(19), one O(2), one O(3), and one O(5) atom to form PO4 tetrahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Cr(4)O6 octahedra, and corners with two equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-57°. There are twenty inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Li(1), one Cr(4), and one P(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Li(1), one Cr(1), and one P(4) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(4), one Cr(1), and one P(4) atom. In the fourth O site, O(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Li(4), one Cr(2), and one Cr(4) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one Cr(4) and one P(4) atom. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(1), and one Cr(3) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Li(4), one Cr(4), and one P(1) atom. In the eighth O site, O(8) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(3), one Cr(2), and one Cr(4) atom. In the ninth O site, O(9) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(4), and one P(2) atom. In the tenth O site, O(10) is bonded in a 4-coordinate geometry to one Li(1), one Li(4), one Cr(1), and one P(3) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Li(3), one Cr(3), and one P(2) atom. In the twelfth O site, O(12) is bonded in a 3-coordinate geometry to one Li(2), one Cr(3), and one P(2) atom. In the thirteenth O site, O(13) is bonded in a bent 150 degrees geometry to one Cr(1) and one P(1) atom. In the fourteenth O site, O(14) is bonded in a bent 150 degrees geometry to one Cr(3) and one P(3) atom. In the fifteenth O site, O(15) is bonded in a bent 150 degrees geometry to one Cr(2) and one P(2) atom. In the sixteenth O site, O(16) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(3), one Cr(1), and one Cr(3) atom. In the seventeenth O site, O(17) is bonded in a 3-coordinate geometry to one Li(2), one Cr(2), and one P(3) atom. In the eighteenth O site, O(18) is bonded in a 3-coordinate geometry to one Li(3), one Cr(2), and one P(3) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Cr(2), and one P(4) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Cr(3), and one P(1) atom. is represented by the CIF card [CIF]
data_LiCrPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.130
_cell_length_b   6.399
_cell_length_c   7.445
_cell_angle_alpha   90.014
_cell_angle_beta   90.144
_cell_angle_gamma   89.972
_symmetry_Int_Tables_number   1
_cell_volume   339.691
_cell_formula_units_Z   4
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
  Li  Li0  1  0.999  0.002  1.000  1.0
  Li  Li1  1  0.499  0.500  0.500  1.0
  Li  Li2  1  0.499  0.999  0.499  1.0
  Li  Li3  1  0.998  0.497  0.999  1.0
  Cr  Cr4  1  0.862  0.750  0.269  1.0
  Cr  Cr5  1  0.638  0.249  0.771  1.0
  Cr  Cr6  1  0.366  0.750  0.227  1.0
  Cr  Cr7  1  0.140  0.249  0.730  1.0
  P  P8  1  0.125  0.750  0.627  1.0
  P  P9  1  0.372  0.250  0.125  1.0
  P  P10  1  0.630  0.750  0.873  1.0
  P  P11  1  0.874  0.250  0.374  1.0
  O  O12  1  0.131  0.942  0.756  1.0
  O  O13  1  0.871  0.059  0.246  1.0
  O  O14  1  0.871  0.441  0.246  1.0
  O  O15  1  0.888  0.254  0.818  1.0
  O  O16  1  0.056  0.249  0.486  1.0
  O  O17  1  0.130  0.750  0.179  1.0
  O  O18  1  0.131  0.558  0.755  1.0
  O  O19  1  0.390  0.253  0.676  1.0
  O  O20  1  0.195  0.250  0.003  1.0
  O  O21  1  0.806  0.750  0.996  1.0
  O  O22  1  0.371  0.059  0.253  1.0
  O  O23  1  0.371  0.441  0.252  1.0
  O  O24  1  0.943  0.750  0.517  1.0
  O  O25  1  0.449  0.750  0.991  1.0
  O  O26  1  0.553  0.249  0.011  1.0
  O  O27  1  0.591  0.750  0.323  1.0
  O  O28  1  0.627  0.558  0.748  1.0
  O  O29  1  0.627  0.941  0.748  1.0
  O  O30  1  0.695  0.249  0.496  1.0
  O  O31  1  0.303  0.750  0.505  1.0
[/CIF]
.