The material structure described by LiCaP crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to four equivalent P(1) atoms to form a mixture of corner and edge-sharing LiP4 tetrahedra. Ca(1) is bonded in a 5-coordinate geometry to five equivalent P(1) atoms. P(1) is bonded in a 9-coordinate geometry to four equivalent Li(1) and five equivalent Ca(1) atoms. is represented by the CIF card [CIF]
data_LiCaP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.178
_cell_length_b   7.056
_cell_length_c   7.773
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   229.147
_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  0.250  0.643  0.564  1.0
  Li  Li1  1  0.750  0.357  0.436  1.0
  Li  Li2  1  0.750  0.857  0.064  1.0
  Li  Li3  1  0.250  0.143  0.936  1.0
  Ca  Ca4  1  0.250  0.518  0.194  1.0
  Ca  Ca5  1  0.750  0.482  0.806  1.0
  Ca  Ca6  1  0.750  0.982  0.694  1.0
  Ca  Ca7  1  0.250  0.018  0.306  1.0
  P  P8  1  0.250  0.768  0.895  1.0
  P  P9  1  0.750  0.232  0.105  1.0
  P  P10  1  0.750  0.732  0.395  1.0
  P  P11  1  0.250  0.268  0.605  1.0
[/CIF]
.
The material structure described by LiCaP crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to four equivalent P(1) atoms to form a mixture of corner and edge-sharing LiP4 tetrahedra. Ca(1) is bonded in a 5-coordinate geometry to five equivalent P(1) atoms. P(1) is bonded in a 9-coordinate geometry to four equivalent Li(1) and five equivalent Ca(1) atoms. is represented by the CIF card [CIF]
data_LiCaP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.178
_cell_length_b   7.056
_cell_length_c   7.773
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   229.147
_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  0.250  0.643  0.564  1.0
  Li  Li1  1  0.750  0.357  0.436  1.0
  Li  Li2  1  0.750  0.857  0.064  1.0
  Li  Li3  1  0.250  0.143  0.936  1.0
  Ca  Ca4  1  0.250  0.518  0.194  1.0
  Ca  Ca5  1  0.750  0.482  0.806  1.0
  Ca  Ca6  1  0.750  0.982  0.694  1.0
  Ca  Ca7  1  0.250  0.018  0.306  1.0
  P  P8  1  0.250  0.768  0.895  1.0
  P  P9  1  0.750  0.232  0.105  1.0
  P  P10  1  0.750  0.732  0.395  1.0
  P  P11  1  0.250  0.268  0.605  1.0
[/CIF]
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