The material described by Li6CrCoP2(CO7)2 crystallizes in the monoclinic Cm space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(14), one O(2), and two equivalent O(16) atoms. In the second Li site, Li(2) is bonded in a 4-coordinate geometry to one O(15), one O(3), and two equivalent O(17) atoms. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(1), one O(13), one O(18), and one O(19) atom. In the fourth Li site, Li(4) is bonded to one O(17), one O(2), one O(4), one O(5), and one O(6) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Co(1)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,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 67-86°. In the fifth Li site, Li(5) is bonded to one O(16), one O(3), one O(4), one O(5), and one O(7) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Co(1)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,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 67-85°. In the sixth Li site, Li(6) is bonded to one O(11), one O(13), one O(18), one O(8), and one O(9) atom to form LiO5 trigonal bipyramids that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Co(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  an edgeedge with one Cr(1)O6 octahedra,  an edgeedge with one Li(6)O5 trigonal bipyramid, and  an edgeedge with one Li(7)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 65-86°. In the seventh Li site, Li(7) is bonded to one O(10), one O(12), one O(13), one O(19), and one O(8) atom to form LiO5 trigonal bipyramids that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Co(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  an edgeedge with one Cr(2)O6 octahedra,  an edgeedge with one Li(6)O5 trigonal bipyramid, and  an edgeedge with one Li(7)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 64-86°. There are two inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to one O(12), one O(15), one O(7), one O(9), and two equivalent O(18) atoms to form distorted CrO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra, corners with two equivalent Li(5)O5 trigonal bipyramids, corners with two equivalent Li(7)O5 trigonal bipyramids, and edges with two equivalent Li(6)O5 trigonal bipyramids. In the second Cr site, Cr(2) is bonded to one O(10), one O(11), one O(14), one O(6), and two equivalent O(19) atoms to form distorted CrO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(6)O5 trigonal bipyramids, and edges with two equivalent Li(7)O5 trigonal bipyramids. Co(1) is bonded to one O(1), one O(16), one O(17), one O(4), one O(5), and one O(8) atom to form distorted CoO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  a cornercorner with one Li(4)O5 trigonal bipyramid,  a cornercorner with one Li(5)O5 trigonal bipyramid,  a cornercorner with one Li(6)O5 trigonal bipyramid,  a cornercorner with one Li(7)O5 trigonal bipyramid,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. There are three inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(13), and one O(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(11), one O(14), and one O(3) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one O(12), one O(15), and one O(2) atom. There are three inequivalent P sites. In the first P site, P(1) is bonded to one O(6), one O(9), and two equivalent O(16) atoms to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(5)O5 trigonal bipyramids, and corners with two equivalent Li(6)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 47-65°. In the second P site, P(2) is bonded to one O(10), one O(7), and two equivalent O(17) atoms to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(5)O5 trigonal bipyramids, and corners with two equivalent Li(7)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 47-65°. In the third P site, P(3) is bonded to one O(18), one O(19), one O(5), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra,  a cornercorner with one Li(4)O5 trigonal bipyramid,  a cornercorner with one Li(5)O5 trigonal bipyramid, corners with two equivalent Li(6)O5 trigonal bipyramids, and corners with two equivalent Li(7)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 45-61°. There are nineteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Li(3), one Co(1), and one C(1) atom. In the second O site, O(2) is bonded to one Li(1), two equivalent Li(4), and one C(3) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(12)Li2CrC trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, and  an edgeedge with one O(6)Li2CrP tetrahedra. In the third O site, O(3) is bonded to one Li(2), two equivalent Li(5), and one C(2) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(11)Li2CrC trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, and  an edgeedge with one O(7)Li2CrP tetrahedra. In the fourth O site, O(4) is bonded to one Li(4), one Li(5), one Co(1), and one C(1) atom to form distorted OLi2CoC trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(13)Li3C tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(4), one Li(5), one Co(1), and one P(3) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra,  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(18)Li2CrP trigonal pyramid,  a cornercorner with one O(19)Li2CrP trigonal pyramid,  an edgeedge with one O(4)Li2CoC trigonal pyramid,  an edgeedge with one O(16)Li2CoP trigonal pyramid, and  an edgeedge with one O(17)Li2CoP trigonal pyramid. In the sixth O site, O(6) is bonded to two equivalent Li(4), one Cr(2), and one P(1) atom to form distorted OLi2CrP tetrahedra that share  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(2)Li3C tetrahedra. In the seventh O site, O(7) is bonded to two equivalent Li(5), one Cr(1), and one P(2) atom to form distorted OLi2CrP tetrahedra that share  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(18)Li2CrP trigonal pyramids, and  an edgeedge with one O(3)Li3C tetrahedra. In the eighth O site, O(8) is bonded to one Li(6), one Li(7), one Co(1), and one P(3) atom to form distorted OLi2CoP tetrahedra that share  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(16)Li2CoP trigonal pyramid,  a cornercorner with one O(17)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(13)Li3C tetrahedra. In the ninth O site, O(9) is bonded to two equivalent Li(6), one Cr(1), and one P(1) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(12)Li2CrC trigonal pyramid, corners with two equivalent O(16)Li2CoP trigonal pyramids,  an edgeedge with one O(11)Li2CrC trigonal pyramid, and edges with two equivalent O(18)Li2CrP trigonal pyramids. In the tenth O site, O(10) is bonded to two equivalent Li(7), one Cr(2), and one P(2) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(11)Li2CrC trigonal pyramid, corners with two equivalent O(17)Li2CoP trigonal pyramids,  an edgeedge with one O(12)Li2CrC trigonal pyramid, and edges with two equivalent O(19)Li2CrP trigonal pyramids. In the eleventh O site, O(11) is bonded to two equivalent Li(6), one Cr(2), and one C(2) atom to form distorted OLi2CrC trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(10)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(9)Li2CrP trigonal pyramid. In the twelfth O site, O(12) is bonded to two equivalent Li(7), one Cr(1), and one C(3) atom to form distorted OLi2CrC trigonal pyramids that share  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(10)Li2CrP trigonal pyramid. In the thirteenth O site, O(13) is bonded to one Li(3), one Li(6), one Li(7), and one C(1) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(8)Li2CoP tetrahedra. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Cr(2), and one C(2) atom. In the fifteenth O site, O(15) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Cr(1), and one C(3) atom. In the sixteenth O site, O(16) is bonded to one Li(1), one Li(5), one Co(1), and one P(1) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(17)Li2CoP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids,  an edgeedge with one O(16)Li2CoP trigonal pyramid, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the seventeenth O site, O(17) is bonded to one Li(2), one Li(4), one Co(1), and one P(2) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(16)Li2CoP trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids,  an edgeedge with one O(17)Li2CoP trigonal pyramid, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the eighteenth O site, O(18) is bonded to one Li(3), one Li(6), one Cr(1), and one P(3) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(18)Li2CrP trigonal pyramid,  an edgeedge with one O(19)Li2CrP trigonal pyramid, and  an edgeedge with one O(9)Li2CrP trigonal pyramid. In the nineteenth O site, O(19) is bonded to one Li(3), one Li(7), one Cr(2), and one P(3) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(19)Li2CrP trigonal pyramid,  an edgeedge with one O(10)Li2CrP trigonal pyramid, and  an edgeedge with one O(18)Li2CrP trigonal pyramid. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li6CrCoP2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.001
_cell_length_b   6.446
_cell_length_c   8.602
_cell_angle_alpha   90.001
_cell_angle_beta   84.668
_cell_angle_gamma   90.008
_symmetry_Int_Tables_number   1
_cell_volume   276.087
_cell_formula_units_Z   1
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
  C  C0  1  0.691  0.750  0.040  1.0
  C  C1  1  0.307  0.250  0.965  1.0
  Co  Co2  1  0.796  0.750  0.334  1.0
  Cr  Cr3  1  0.203  0.250  0.665  1.0
  Li  Li4  1  0.784  0.250  0.111  1.0
  Li  Li5  1  0.215  0.750  0.894  1.0
  Li  Li6  1  0.267  0.021  0.271  1.0
  Li  Li7  1  0.267  0.479  0.271  1.0
  Li  Li8  1  0.729  0.519  0.729  1.0
  Li  Li9  1  0.729  0.981  0.729  1.0
  O  O10  1  0.941  0.750  0.066  1.0
  O  O11  1  0.393  0.250  0.103  1.0
  O  O12  1  0.512  0.749  0.161  1.0
  O  O13  1  0.174  0.750  0.420  1.0
  O  O14  1  0.418  0.250  0.418  1.0
  O  O15  1  0.586  0.750  0.568  1.0
  O  O16  1  0.817  0.250  0.578  1.0
  O  O17  1  0.481  0.250  0.840  1.0
  O  O18  1  0.616  0.750  0.899  1.0
  O  O19  1  0.055  0.250  0.946  1.0
  O  O20  1  0.845  0.062  0.311  1.0
  O  O21  1  0.845  0.438  0.311  1.0
  O  O22  1  0.164  0.936  0.688  1.0
  O  O23  1  0.164  0.564  0.688  1.0
  P  P24  1  0.729  0.250  0.410  1.0
  P  P25  1  0.273  0.750  0.585  1.0
[/CIF]
.
The material described by Li6CrCoP2(CO7)2 crystallizes in the monoclinic Cm space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(14), one O(2), and two equivalent O(16) atoms. In the second Li site, Li(2) is bonded in a 4-coordinate geometry to one O(15), one O(3), and two equivalent O(17) atoms. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(1), one O(13), one O(18), and one O(19) atom. In the fourth Li site, Li(4) is bonded to one O(17), one O(2), one O(4), one O(5), and one O(6) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Co(1)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,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 67-86°. In the fifth Li site, Li(5) is bonded to one O(16), one O(3), one O(4), one O(5), and one O(7) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Co(1)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,  an edgeedge with one Co(1)O6 octahedra,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 67-85°. In the sixth Li site, Li(6) is bonded to one O(11), one O(13), one O(18), one O(8), and one O(9) atom to form LiO5 trigonal bipyramids that share  a cornercorner with one Cr(2)O6 octahedra,  a cornercorner with one Co(1)O6 octahedra,  a cornercorner with one P(1)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  an edgeedge with one Cr(1)O6 octahedra,  an edgeedge with one Li(6)O5 trigonal bipyramid, and  an edgeedge with one Li(7)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 65-86°. In the seventh Li site, Li(7) is bonded to one O(10), one O(12), one O(13), one O(19), and one O(8) atom to form LiO5 trigonal bipyramids that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Co(1)O6 octahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  an edgeedge with one Cr(2)O6 octahedra,  an edgeedge with one Li(6)O5 trigonal bipyramid, and  an edgeedge with one Li(7)O5 trigonal bipyramid. The corner-sharing octahedral tilt angles range from 64-86°. There are two inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to one O(12), one O(15), one O(7), one O(9), and two equivalent O(18) atoms to form distorted CrO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra, corners with two equivalent Li(5)O5 trigonal bipyramids, corners with two equivalent Li(7)O5 trigonal bipyramids, and edges with two equivalent Li(6)O5 trigonal bipyramids. In the second Cr site, Cr(2) is bonded to one O(10), one O(11), one O(14), one O(6), and two equivalent O(19) atoms to form distorted CrO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(6)O5 trigonal bipyramids, and edges with two equivalent Li(7)O5 trigonal bipyramids. Co(1) is bonded to one O(1), one O(16), one O(17), one O(4), one O(5), and one O(8) atom to form distorted CoO6 octahedra that share  a cornercorner with one P(1)O4 tetrahedra,  a cornercorner with one P(2)O4 tetrahedra, corners with two equivalent P(3)O4 tetrahedra,  a cornercorner with one Li(4)O5 trigonal bipyramid,  a cornercorner with one Li(5)O5 trigonal bipyramid,  a cornercorner with one Li(6)O5 trigonal bipyramid,  a cornercorner with one Li(7)O5 trigonal bipyramid,  an edgeedge with one Li(4)O5 trigonal bipyramid, and  an edgeedge with one Li(5)O5 trigonal bipyramid. There are three inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(1), one O(13), and one O(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(11), one O(14), and one O(3) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one O(12), one O(15), and one O(2) atom. There are three inequivalent P sites. In the first P site, P(1) is bonded to one O(6), one O(9), and two equivalent O(16) atoms to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(5)O5 trigonal bipyramids, and corners with two equivalent Li(6)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 47-65°. In the second P site, P(2) is bonded to one O(10), one O(7), and two equivalent O(17) atoms to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra, corners with two equivalent Li(4)O5 trigonal bipyramids, corners with two equivalent Li(5)O5 trigonal bipyramids, and corners with two equivalent Li(7)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 47-65°. In the third P site, P(3) is bonded to one O(18), one O(19), one O(5), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one Cr(1)O6 octahedra,  a cornercorner with one Cr(2)O6 octahedra, corners with two equivalent Co(1)O6 octahedra,  a cornercorner with one Li(4)O5 trigonal bipyramid,  a cornercorner with one Li(5)O5 trigonal bipyramid, corners with two equivalent Li(6)O5 trigonal bipyramids, and corners with two equivalent Li(7)O5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 45-61°. There are nineteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Li(3), one Co(1), and one C(1) atom. In the second O site, O(2) is bonded to one Li(1), two equivalent Li(4), and one C(3) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(12)Li2CrC trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, and  an edgeedge with one O(6)Li2CrP tetrahedra. In the third O site, O(3) is bonded to one Li(2), two equivalent Li(5), and one C(2) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(11)Li2CrC trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, and  an edgeedge with one O(7)Li2CrP tetrahedra. In the fourth O site, O(4) is bonded to one Li(4), one Li(5), one Co(1), and one C(1) atom to form distorted OLi2CoC trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(13)Li3C tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(4), one Li(5), one Co(1), and one P(3) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra,  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(18)Li2CrP trigonal pyramid,  a cornercorner with one O(19)Li2CrP trigonal pyramid,  an edgeedge with one O(4)Li2CoC trigonal pyramid,  an edgeedge with one O(16)Li2CoP trigonal pyramid, and  an edgeedge with one O(17)Li2CoP trigonal pyramid. In the sixth O site, O(6) is bonded to two equivalent Li(4), one Cr(2), and one P(1) atom to form distorted OLi2CrP tetrahedra that share  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(2)Li3C tetrahedra. In the seventh O site, O(7) is bonded to two equivalent Li(5), one Cr(1), and one P(2) atom to form distorted OLi2CrP tetrahedra that share  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids, corners with two equivalent O(16)Li2CoP trigonal pyramids, corners with two equivalent O(17)Li2CoP trigonal pyramids, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(18)Li2CrP trigonal pyramids, and  an edgeedge with one O(3)Li3C tetrahedra. In the eighth O site, O(8) is bonded to one Li(6), one Li(7), one Co(1), and one P(3) atom to form distorted OLi2CoP tetrahedra that share  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(16)Li2CoP trigonal pyramid,  a cornercorner with one O(17)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(5)Li2CoP trigonal pyramids, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(13)Li3C tetrahedra. In the ninth O site, O(9) is bonded to two equivalent Li(6), one Cr(1), and one P(1) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(12)Li2CrC trigonal pyramid, corners with two equivalent O(16)Li2CoP trigonal pyramids,  an edgeedge with one O(11)Li2CrC trigonal pyramid, and edges with two equivalent O(18)Li2CrP trigonal pyramids. In the tenth O site, O(10) is bonded to two equivalent Li(7), one Cr(2), and one P(2) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(11)Li2CrC trigonal pyramid, corners with two equivalent O(17)Li2CoP trigonal pyramids,  an edgeedge with one O(12)Li2CrC trigonal pyramid, and edges with two equivalent O(19)Li2CrP trigonal pyramids. In the eleventh O site, O(11) is bonded to two equivalent Li(6), one Cr(2), and one C(2) atom to form distorted OLi2CrC trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(10)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(9)Li2CrP trigonal pyramid. In the twelfth O site, O(12) is bonded to two equivalent Li(7), one Cr(1), and one C(3) atom to form distorted OLi2CrC trigonal pyramids that share  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(10)Li2CrP trigonal pyramid. In the thirteenth O site, O(13) is bonded to one Li(3), one Li(6), one Li(7), and one C(1) atom to form distorted OLi3C tetrahedra that share  a cornercorner with one O(4)Li2CoC trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(18)Li2CrP trigonal pyramids, corners with two equivalent O(19)Li2CrP trigonal pyramids, and  an edgeedge with one O(8)Li2CoP tetrahedra. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Cr(2), and one C(2) atom. In the fifteenth O site, O(15) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Cr(1), and one C(3) atom. In the sixteenth O site, O(16) is bonded to one Li(1), one Li(5), one Co(1), and one P(1) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(17)Li2CoP trigonal pyramid,  a cornercorner with one O(9)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids,  an edgeedge with one O(16)Li2CoP trigonal pyramid, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the seventeenth O site, O(17) is bonded to one Li(2), one Li(4), one Co(1), and one P(2) atom to form distorted OLi2CoP trigonal pyramids that share  a cornercorner with one O(8)Li2CoP tetrahedra,  a cornercorner with one O(6)Li2CrP tetrahedra,  a cornercorner with one O(7)Li2CrP tetrahedra,  a cornercorner with one O(2)Li3C tetrahedra,  a cornercorner with one O(3)Li3C tetrahedra,  a cornercorner with one O(16)Li2CoP trigonal pyramid,  a cornercorner with one O(10)Li2CrP trigonal pyramid, corners with two equivalent O(4)Li2CoC trigonal pyramids,  an edgeedge with one O(17)Li2CoP trigonal pyramid, and  an edgeedge with one O(5)Li2CoP trigonal pyramid. In the eighteenth O site, O(18) is bonded to one Li(3), one Li(6), one Cr(1), and one P(3) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(7)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(18)Li2CrP trigonal pyramid,  an edgeedge with one O(19)Li2CrP trigonal pyramid, and  an edgeedge with one O(9)Li2CrP trigonal pyramid. In the nineteenth O site, O(19) is bonded to one Li(3), one Li(7), one Cr(2), and one P(3) atom to form distorted OLi2CrP trigonal pyramids that share  a cornercorner with one O(6)Li2CrP tetrahedra, corners with two equivalent O(8)Li2CoP tetrahedra, corners with two equivalent O(13)Li3C tetrahedra,  a cornercorner with one O(5)Li2CoP trigonal pyramid,  a cornercorner with one O(11)Li2CrC trigonal pyramid,  a cornercorner with one O(12)Li2CrC trigonal pyramid,  a cornercorner with one O(19)Li2CrP trigonal pyramid,  an edgeedge with one O(10)Li2CrP trigonal pyramid, and  an edgeedge with one O(18)Li2CrP trigonal pyramid. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li6CrCoP2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.001
_cell_length_b   6.446
_cell_length_c   8.602
_cell_angle_alpha   90.001
_cell_angle_beta   84.668
_cell_angle_gamma   90.008
_symmetry_Int_Tables_number   1
_cell_volume   276.087
_cell_formula_units_Z   1
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
  C  C0  1  0.691  0.750  0.040  1.0
  C  C1  1  0.307  0.250  0.965  1.0
  Co  Co2  1  0.796  0.750  0.334  1.0
  Cr  Cr3  1  0.203  0.250  0.665  1.0
  Li  Li4  1  0.784  0.250  0.111  1.0
  Li  Li5  1  0.215  0.750  0.894  1.0
  Li  Li6  1  0.267  0.021  0.271  1.0
  Li  Li7  1  0.267  0.479  0.271  1.0
  Li  Li8  1  0.729  0.519  0.729  1.0
  Li  Li9  1  0.729  0.981  0.729  1.0
  O  O10  1  0.941  0.750  0.066  1.0
  O  O11  1  0.393  0.250  0.103  1.0
  O  O12  1  0.512  0.749  0.161  1.0
  O  O13  1  0.174  0.750  0.420  1.0
  O  O14  1  0.418  0.250  0.418  1.0
  O  O15  1  0.586  0.750  0.568  1.0
  O  O16  1  0.817  0.250  0.578  1.0
  O  O17  1  0.481  0.250  0.840  1.0
  O  O18  1  0.616  0.750  0.899  1.0
  O  O19  1  0.055  0.250  0.946  1.0
  O  O20  1  0.845  0.062  0.311  1.0
  O  O21  1  0.845  0.438  0.311  1.0
  O  O22  1  0.164  0.936  0.688  1.0
  O  O23  1  0.164  0.564  0.688  1.0
  P  P24  1  0.729  0.250  0.410  1.0
  P  P25  1  0.273  0.750  0.585  1.0
[/CIF]
.