The material structure described by Na3Li3Mn2P2(CO7)2 crystallizes in the triclinic P1 space group. There are three inequivalent Na sites. In the first Na site, Na(1) is bonded in a 5-coordinate geometry to one O(1), one O(3), one O(4), one O(6), and one O(7) atom. In the second Na site, Na(2) is bonded in a 7-coordinate geometry to one O(1), one O(2), one O(3), one O(6), one O(7), and two equivalent O(5) atoms. In the third Na site, Na(3) is bonded in a 7-coordinate geometry to one O(12), one O(13), one O(14), one O(8), one O(9), and two equivalent O(10) atoms. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(1), one O(13), one O(4), and one O(5) atom. In the second Li site, Li(2) is bonded to one O(11), one O(12), one O(14), one O(8), and one O(9) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one P(1)O4 tetrahedra and corners with two equivalent P(2)O4 tetrahedra. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(10), one O(11), one O(14), and one O(2) atom. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 5-coordinate geometry to one O(3), one O(4), one O(5), one O(7), and one O(9) atom. In the second Mn site, Mn(2) is bonded in a 5-coordinate geometry to one O(10), one O(11), one O(12), one O(6), and one O(8) atom. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(14), one O(2), and one O(3) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(1), one O(12), and one O(13) atom. There are two inequivalent P sites. In the first P site, P(1) is bonded to one O(4), one O(5), one O(6), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one Li(2)O5 trigonal bipyramid. In the second P site, P(2) is bonded to one O(10), one O(11), one O(7), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent Li(2)O5 trigonal bipyramids. There are fourteen inequivalent O sites. In the first O site, O(1) is bonded to one Na(1), one Na(2), one Li(1), and one C(2) atom to form distorted edge-sharing ONa2LiC tetrahedra. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one Na(2), one Li(3), and one C(1) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Na(1), one Na(2), one Mn(1), and one C(1) atom. In the fourth O site, O(4) is bonded in a 4-coordinate geometry to one Na(1), one Li(1), one Mn(1), and one P(1) atom. In the fifth O site, O(5) is bonded in a 4-coordinate geometry to two equivalent Na(2), one Li(1), one Mn(1), and one P(1) atom. In the sixth O site, O(6) is bonded to one Na(1), one Na(2), one Mn(2), and one P(1) atom to form distorted edge-sharing ONa2MnP tetrahedra. In the seventh O site, O(7) is bonded in a rectangular see-saw-like geometry to one Na(1), one Na(2), one Mn(1), and one P(2) atom. In the eighth O site, O(8) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(2), and one P(1) atom. In the ninth O site, O(9) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(1), and one P(2) atom. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to two equivalent Na(3), one Li(3), one Mn(2), and one P(2) atom. In the eleventh O site, O(11) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Mn(2), and one P(2) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(2), and one C(2) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one Na(3), one Li(1), and one C(2) atom. In the fourteenth O site, O(14) is bonded in a distorted tetrahedral geometry to one Na(3), one Li(2), one Li(3), and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Na3Li3Mn2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.118
_cell_length_b   6.805
_cell_length_c   8.812
_cell_angle_alpha   88.181
_cell_angle_beta   86.797
_cell_angle_gamma   89.620
_symmetry_Int_Tables_number   1
_cell_volume   306.217
_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  0.282  0.234  0.958  1.0
  C  C1  1  0.699  0.755  0.048  1.0
  Li  Li2  1  0.220  0.765  0.896  1.0
  Li  Li3  1  0.256  0.034  0.276  1.0
  Li  Li4  1  0.766  0.218  0.103  1.0
  Mn  Mn5  1  0.226  0.246  0.639  1.0
  Mn  Mn6  1  0.788  0.763  0.355  1.0
  Na  Na7  1  0.737  0.991  0.746  1.0
  Na  Na8  1  0.739  0.500  0.750  1.0
  Na  Na9  1  0.265  0.505  0.245  1.0
  O  O10  1  0.601  0.740  0.916  1.0
  O  O11  1  0.034  0.235  0.935  1.0
  O  O12  1  0.451  0.241  0.841  1.0
  O  O13  1  0.190  0.925  0.690  1.0
  O  O14  1  0.195  0.562  0.677  1.0
  O  O15  1  0.590  0.755  0.570  1.0
  O  O16  1  0.833  0.250  0.568  1.0
  O  O17  1  0.179  0.771  0.426  1.0
  O  O18  1  0.425  0.228  0.422  1.0
  O  O19  1  0.801  0.445  0.314  1.0
  O  O20  1  0.850  0.083  0.308  1.0
  O  O21  1  0.539  0.778  0.167  1.0
  O  O22  1  0.949  0.748  0.063  1.0
  O  O23  1  0.370  0.226  0.094  1.0
  P  P24  1  0.286  0.752  0.588  1.0
  P  P25  1  0.730  0.253  0.406  1.0
[/CIF]
.
The material structure described by Na3Li3Mn2P2(CO7)2 crystallizes in the triclinic P1 space group. There are three inequivalent Na sites. In the first Na site, Na(1) is bonded in a 5-coordinate geometry to one O(1), one O(3), one O(4), one O(6), and one O(7) atom. In the second Na site, Na(2) is bonded in a 7-coordinate geometry to one O(1), one O(2), one O(3), one O(6), one O(7), and two equivalent O(5) atoms. In the third Na site, Na(3) is bonded in a 7-coordinate geometry to one O(12), one O(13), one O(14), one O(8), one O(9), and two equivalent O(10) atoms. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one O(1), one O(13), one O(4), and one O(5) atom. In the second Li site, Li(2) is bonded to one O(11), one O(12), one O(14), one O(8), and one O(9) atom to form distorted LiO5 trigonal bipyramids that share  a cornercorner with one P(1)O4 tetrahedra and corners with two equivalent P(2)O4 tetrahedra. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(10), one O(11), one O(14), and one O(2) atom. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 5-coordinate geometry to one O(3), one O(4), one O(5), one O(7), and one O(9) atom. In the second Mn site, Mn(2) is bonded in a 5-coordinate geometry to one O(10), one O(11), one O(12), one O(6), and one O(8) atom. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one O(14), one O(2), and one O(3) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one O(1), one O(12), and one O(13) atom. There are two inequivalent P sites. In the first P site, P(1) is bonded to one O(4), one O(5), one O(6), and one O(8) atom to form PO4 tetrahedra that share  a cornercorner with one Li(2)O5 trigonal bipyramid. In the second P site, P(2) is bonded to one O(10), one O(11), one O(7), and one O(9) atom to form PO4 tetrahedra that share corners with two equivalent Li(2)O5 trigonal bipyramids. There are fourteen inequivalent O sites. In the first O site, O(1) is bonded to one Na(1), one Na(2), one Li(1), and one C(2) atom to form distorted edge-sharing ONa2LiC tetrahedra. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one Na(2), one Li(3), and one C(1) atom. In the third O site, O(3) is bonded in a distorted rectangular see-saw-like geometry to one Na(1), one Na(2), one Mn(1), and one C(1) atom. In the fourth O site, O(4) is bonded in a 4-coordinate geometry to one Na(1), one Li(1), one Mn(1), and one P(1) atom. In the fifth O site, O(5) is bonded in a 4-coordinate geometry to two equivalent Na(2), one Li(1), one Mn(1), and one P(1) atom. In the sixth O site, O(6) is bonded to one Na(1), one Na(2), one Mn(2), and one P(1) atom to form distorted edge-sharing ONa2MnP tetrahedra. In the seventh O site, O(7) is bonded in a rectangular see-saw-like geometry to one Na(1), one Na(2), one Mn(1), and one P(2) atom. In the eighth O site, O(8) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(2), and one P(1) atom. In the ninth O site, O(9) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(1), and one P(2) atom. In the tenth O site, O(10) is bonded in a 5-coordinate geometry to two equivalent Na(3), one Li(3), one Mn(2), and one P(2) atom. In the eleventh O site, O(11) is bonded in a 4-coordinate geometry to one Li(2), one Li(3), one Mn(2), and one P(2) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one Na(3), one Li(2), one Mn(2), and one C(2) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one Na(3), one Li(1), and one C(2) atom. In the fourteenth O site, O(14) is bonded in a distorted tetrahedral geometry to one Na(3), one Li(2), one Li(3), and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Na3Li3Mn2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.118
_cell_length_b   6.805
_cell_length_c   8.812
_cell_angle_alpha   88.181
_cell_angle_beta   86.797
_cell_angle_gamma   89.620
_symmetry_Int_Tables_number   1
_cell_volume   306.217
_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  0.282  0.234  0.958  1.0
  C  C1  1  0.699  0.755  0.048  1.0
  Li  Li2  1  0.220  0.765  0.896  1.0
  Li  Li3  1  0.256  0.034  0.276  1.0
  Li  Li4  1  0.766  0.218  0.103  1.0
  Mn  Mn5  1  0.226  0.246  0.639  1.0
  Mn  Mn6  1  0.788  0.763  0.355  1.0
  Na  Na7  1  0.737  0.991  0.746  1.0
  Na  Na8  1  0.739  0.500  0.750  1.0
  Na  Na9  1  0.265  0.505  0.245  1.0
  O  O10  1  0.601  0.740  0.916  1.0
  O  O11  1  0.034  0.235  0.935  1.0
  O  O12  1  0.451  0.241  0.841  1.0
  O  O13  1  0.190  0.925  0.690  1.0
  O  O14  1  0.195  0.562  0.677  1.0
  O  O15  1  0.590  0.755  0.570  1.0
  O  O16  1  0.833  0.250  0.568  1.0
  O  O17  1  0.179  0.771  0.426  1.0
  O  O18  1  0.425  0.228  0.422  1.0
  O  O19  1  0.801  0.445  0.314  1.0
  O  O20  1  0.850  0.083  0.308  1.0
  O  O21  1  0.539  0.778  0.167  1.0
  O  O22  1  0.949  0.748  0.063  1.0
  O  O23  1  0.370  0.226  0.094  1.0
  P  P24  1  0.286  0.752  0.588  1.0
  P  P25  1  0.730  0.253  0.406  1.0
[/CIF]
.