The crystal structure described by LiVMnP2(O4F)2 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 4-coordinate geometry to one O(4), one O(5), one O(6), and one F(1) atom. V(1) is bonded in a 2-coordinate geometry to one O(1), one O(8), one F(1), and one F(2) atom. Mn(1) is bonded in a distorted linear geometry to one O(2), one O(3), one O(6), and one O(7) atom. There are two inequivalent P sites. In the first P site, P(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(3), and one O(5) atom. In the second P site, P(2) is bonded in a 1-coordinate geometry to one O(4), one O(6), one O(7), and one O(8) atom. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one V(1) and one P(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Mn(1) and one P(1) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Mn(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to one Li(1) and one P(2) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Li(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 Mn(1), and one P(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Mn(1) and one P(2) atom. In the eighth O site, O(8) is bonded in a 2-coordinate geometry to one V(1) and one P(2) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a 2-coordinate geometry to one Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnVP2(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.192
_cell_length_b   5.270
_cell_length_c   7.381
_cell_angle_alpha   108.894
_cell_angle_beta   104.790
_cell_angle_gamma   96.996
_symmetry_Int_Tables_number   1
_cell_volume   180.054
_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
  Li  Li0  1  0.921  0.390  0.177  1.0
  Mn  Mn1  1  0.506  0.996  0.504  1.0
  V  V2  1  0.999  0.004  0.993  1.0
  P  P3  1  0.441  0.358  0.759  1.0
  P  P4  1  0.555  0.644  0.241  1.0
  O  O5  1  0.274  0.225  0.911  1.0
  O  O6  1  0.361  0.220  0.603  1.0
  O  O7  1  0.365  0.664  0.665  1.0
  O  O8  1  0.242  0.669  0.132  1.0
  O  O9  1  0.748  0.315  0.892  1.0
  O  O10  1  0.644  0.337  0.336  1.0
  O  O11  1  0.647  0.791  0.392  1.0
  O  O12  1  0.719  0.761  0.087  1.0
  F  F13  1  0.117  0.068  0.246  1.0
  F  F14  1  0.879  0.941  0.751  1.0
[/CIF]
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The crystal structure described by LiVMnP2(O4F)2 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 4-coordinate geometry to one O(4), one O(5), one O(6), and one F(1) atom. V(1) is bonded in a 2-coordinate geometry to one O(1), one O(8), one F(1), and one F(2) atom. Mn(1) is bonded in a distorted linear geometry to one O(2), one O(3), one O(6), and one O(7) atom. There are two inequivalent P sites. In the first P site, P(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(3), and one O(5) atom. In the second P site, P(2) is bonded in a 1-coordinate geometry to one O(4), one O(6), one O(7), and one O(8) atom. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one V(1) and one P(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Mn(1) and one P(1) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Mn(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to one Li(1) and one P(2) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Li(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 Mn(1), and one P(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Mn(1) and one P(2) atom. In the eighth O site, O(8) is bonded in a 2-coordinate geometry to one V(1) and one P(2) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a 2-coordinate geometry to one Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnVP2(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.192
_cell_length_b   5.270
_cell_length_c   7.381
_cell_angle_alpha   108.894
_cell_angle_beta   104.790
_cell_angle_gamma   96.996
_symmetry_Int_Tables_number   1
_cell_volume   180.054
_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
  Li  Li0  1  0.921  0.390  0.177  1.0
  Mn  Mn1  1  0.506  0.996  0.504  1.0
  V  V2  1  0.999  0.004  0.993  1.0
  P  P3  1  0.441  0.358  0.759  1.0
  P  P4  1  0.555  0.644  0.241  1.0
  O  O5  1  0.274  0.225  0.911  1.0
  O  O6  1  0.361  0.220  0.603  1.0
  O  O7  1  0.365  0.664  0.665  1.0
  O  O8  1  0.242  0.669  0.132  1.0
  O  O9  1  0.748  0.315  0.892  1.0
  O  O10  1  0.644  0.337  0.336  1.0
  O  O11  1  0.647  0.791  0.392  1.0
  O  O12  1  0.719  0.761  0.087  1.0
  F  F13  1  0.117  0.068  0.246  1.0
  F  F14  1  0.879  0.941  0.751  1.0
[/CIF]
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