The structure described by LiGeCPO7 crystallizes in the monoclinic P2_1 space group. Li(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), one O(5), and one O(6) atom. Ge(1) is bonded to one O(2), one O(3), one O(4), one O(5), one O(6), and one O(7) atom to form GeO6 octahedra that share corners with four equivalent P(1)O4 tetrahedra. C(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. P(1) is bonded to one O(4), one O(5), one O(6), and one O(7) atom to form PO4 tetrahedra that share corners with four equivalent Ge(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-44°. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Li(1) and one C(1) atom. In the second O site, O(2) is bonded in a T-shaped geometry to one Li(1), one Ge(1), and one C(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Li(1), one Ge(1), and one C(1) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one Ge(1) and one P(1) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(1), one Ge(1), and one P(1) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(1), one Ge(1), and one P(1) atom. In the seventh O site, O(7) is bonded in a distorted bent 150 degrees geometry to one Ge(1) and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiGePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.233
_cell_length_b   5.066
_cell_length_c   8.623
_cell_angle_alpha   85.452
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   271.377
_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
  Li  Li0  1  0.475  0.772  0.817  1.0
  Li  Li1  1  0.975  0.228  0.183  1.0
  Ge  Ge2  1  0.249  0.211  0.663  1.0
  Ge  Ge3  1  0.749  0.789  0.337  1.0
  P  P4  1  0.754  0.265  0.569  1.0
  P  P5  1  0.254  0.735  0.431  1.0
  C  C6  1  0.253  0.275  0.934  1.0
  C  C7  1  0.753  0.725  0.066  1.0
  O  O8  1  0.731  0.686  0.928  1.0
  O  O9  1  0.255  0.039  0.874  1.0
  O  O10  1  0.271  0.468  0.817  1.0
  O  O11  1  0.948  0.196  0.674  1.0
  O  O12  1  0.559  0.180  0.670  1.0
  O  O13  1  0.260  0.873  0.585  1.0
  O  O14  1  0.747  0.571  0.523  1.0
  O  O15  1  0.247  0.429  0.477  1.0
  O  O16  1  0.760  0.127  0.415  1.0
  O  O17  1  0.059  0.820  0.330  1.0
  O  O18  1  0.448  0.804  0.326  1.0
  O  O19  1  0.771  0.532  0.183  1.0
  O  O20  1  0.755  0.961  0.126  1.0
  O  O21  1  0.231  0.314  0.072  1.0
[/CIF]
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The structure described by LiGeCPO7 crystallizes in the monoclinic P2_1 space group. Li(1) is bonded in a 5-coordinate geometry to one O(1), one O(2), one O(3), one O(5), and one O(6) atom. Ge(1) is bonded to one O(2), one O(3), one O(4), one O(5), one O(6), and one O(7) atom to form GeO6 octahedra that share corners with four equivalent P(1)O4 tetrahedra. C(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. P(1) is bonded to one O(4), one O(5), one O(6), and one O(7) atom to form PO4 tetrahedra that share corners with four equivalent Ge(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-44°. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Li(1) and one C(1) atom. In the second O site, O(2) is bonded in a T-shaped geometry to one Li(1), one Ge(1), and one C(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Li(1), one Ge(1), and one C(1) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one Ge(1) and one P(1) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(1), one Ge(1), and one P(1) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(1), one Ge(1), and one P(1) atom. In the seventh O site, O(7) is bonded in a distorted bent 150 degrees geometry to one Ge(1) and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiGePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.233
_cell_length_b   5.066
_cell_length_c   8.623
_cell_angle_alpha   85.452
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   271.377
_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
  Li  Li0  1  0.475  0.772  0.817  1.0
  Li  Li1  1  0.975  0.228  0.183  1.0
  Ge  Ge2  1  0.249  0.211  0.663  1.0
  Ge  Ge3  1  0.749  0.789  0.337  1.0
  P  P4  1  0.754  0.265  0.569  1.0
  P  P5  1  0.254  0.735  0.431  1.0
  C  C6  1  0.253  0.275  0.934  1.0
  C  C7  1  0.753  0.725  0.066  1.0
  O  O8  1  0.731  0.686  0.928  1.0
  O  O9  1  0.255  0.039  0.874  1.0
  O  O10  1  0.271  0.468  0.817  1.0
  O  O11  1  0.948  0.196  0.674  1.0
  O  O12  1  0.559  0.180  0.670  1.0
  O  O13  1  0.260  0.873  0.585  1.0
  O  O14  1  0.747  0.571  0.523  1.0
  O  O15  1  0.247  0.429  0.477  1.0
  O  O16  1  0.760  0.127  0.415  1.0
  O  O17  1  0.059  0.820  0.330  1.0
  O  O18  1  0.448  0.804  0.326  1.0
  O  O19  1  0.771  0.532  0.183  1.0
  O  O20  1  0.755  0.961  0.126  1.0
  O  O21  1  0.231  0.314  0.072  1.0
[/CIF]
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