The compound described by Li4Be3As3O12Cl crystallizes in the cubic P-43n space group. Li(1) is bonded to three equivalent O(1) and one Cl(1) atom to form LiClO3 tetrahedra that share corners with three equivalent Li(1)ClO3 tetrahedra, corners with three equivalent Be(1)O4 tetrahedra, and corners with three equivalent As(1)O4 tetrahedra. Be(1) is bonded to four equivalent O(1) atoms to form BeO4 tetrahedra that share corners with four equivalent Li(1)ClO3 tetrahedra and corners with four equivalent As(1)O4 tetrahedra. As(1) is bonded to four equivalent O(1) atoms to form AsO4 tetrahedra that share corners with four equivalent Li(1)ClO3 tetrahedra and corners with four equivalent Be(1)O4 tetrahedra. O(1) is bonded in a trigonal planar geometry to one Li(1), one Be(1), and one As(1) atom. Cl(1) is bonded in a tetrahedral geometry to four equivalent Li(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li4Be3As3ClO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.356
_cell_length_b   8.356
_cell_length_c   8.356
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   583.377
_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  0.829  0.829  0.171  1.0
  Li  Li1  1  0.329  0.329  0.671  1.0
  Li  Li2  1  0.171  0.171  0.171  1.0
  Li  Li3  1  0.671  0.671  0.671  1.0
  Li  Li4  1  0.829  0.171  0.829  1.0
  Li  Li5  1  0.329  0.671  0.329  1.0
  Li  Li6  1  0.171  0.829  0.829  1.0
  Li  Li7  1  0.671  0.329  0.329  1.0
  Be  Be8  1  0.500  0.750  0.000  1.0
  Be  Be9  1  0.250  0.000  0.500  1.0
  Be  Be10  1  0.000  0.500  0.250  1.0
  Be  Be11  1  0.500  0.250  0.000  1.0
  Be  Be12  1  0.000  0.500  0.750  1.0
  Be  Be13  1  0.750  0.000  0.500  1.0
  As  As14  1  0.500  0.000  0.250  1.0
  As  As15  1  0.000  0.250  0.500  1.0
  As  As16  1  0.250  0.500  0.000  1.0
  As  As17  1  0.000  0.750  0.500  1.0
  As  As18  1  0.500  0.000  0.750  1.0
  As  As19  1  0.750  0.500  0.000  1.0
  Cl  Cl20  1  0.500  0.500  0.500  1.0
  Cl  Cl21  1  0.000  0.000  0.000  1.0
  O  O22  1  0.094  0.364  0.643  1.0
  O  O23  1  0.594  0.857  0.136  1.0
  O  O24  1  0.136  0.406  0.143  1.0
  O  O25  1  0.143  0.136  0.406  1.0
  O  O26  1  0.357  0.906  0.364  1.0
  O  O27  1  0.864  0.594  0.143  1.0
  O  O28  1  0.864  0.406  0.857  1.0
  O  O29  1  0.357  0.094  0.636  1.0
  O  O30  1  0.857  0.864  0.406  1.0
  O  O31  1  0.906  0.364  0.357  1.0
  O  O32  1  0.136  0.594  0.857  1.0
  O  O33  1  0.364  0.357  0.906  1.0
  O  O34  1  0.406  0.143  0.136  1.0
  O  O35  1  0.906  0.636  0.643  1.0
  O  O36  1  0.406  0.857  0.864  1.0
  O  O37  1  0.643  0.094  0.364  1.0
  O  O38  1  0.636  0.357  0.094  1.0
  O  O39  1  0.857  0.136  0.594  1.0
  O  O40  1  0.643  0.906  0.636  1.0
  O  O41  1  0.636  0.643  0.906  1.0
  O  O42  1  0.594  0.143  0.864  1.0
  O  O43  1  0.094  0.636  0.357  1.0
  O  O44  1  0.364  0.643  0.094  1.0
  O  O45  1  0.143  0.864  0.594  1.0
[/CIF]
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The compound described by Li4Be3As3O12Cl crystallizes in the cubic P-43n space group. Li(1) is bonded to three equivalent O(1) and one Cl(1) atom to form LiClO3 tetrahedra that share corners with three equivalent Li(1)ClO3 tetrahedra, corners with three equivalent Be(1)O4 tetrahedra, and corners with three equivalent As(1)O4 tetrahedra. Be(1) is bonded to four equivalent O(1) atoms to form BeO4 tetrahedra that share corners with four equivalent Li(1)ClO3 tetrahedra and corners with four equivalent As(1)O4 tetrahedra. As(1) is bonded to four equivalent O(1) atoms to form AsO4 tetrahedra that share corners with four equivalent Li(1)ClO3 tetrahedra and corners with four equivalent Be(1)O4 tetrahedra. O(1) is bonded in a trigonal planar geometry to one Li(1), one Be(1), and one As(1) atom. Cl(1) is bonded in a tetrahedral geometry to four equivalent Li(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li4Be3As3ClO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.356
_cell_length_b   8.356
_cell_length_c   8.356
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   583.377
_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  0.829  0.829  0.171  1.0
  Li  Li1  1  0.329  0.329  0.671  1.0
  Li  Li2  1  0.171  0.171  0.171  1.0
  Li  Li3  1  0.671  0.671  0.671  1.0
  Li  Li4  1  0.829  0.171  0.829  1.0
  Li  Li5  1  0.329  0.671  0.329  1.0
  Li  Li6  1  0.171  0.829  0.829  1.0
  Li  Li7  1  0.671  0.329  0.329  1.0
  Be  Be8  1  0.500  0.750  0.000  1.0
  Be  Be9  1  0.250  0.000  0.500  1.0
  Be  Be10  1  0.000  0.500  0.250  1.0
  Be  Be11  1  0.500  0.250  0.000  1.0
  Be  Be12  1  0.000  0.500  0.750  1.0
  Be  Be13  1  0.750  0.000  0.500  1.0
  As  As14  1  0.500  0.000  0.250  1.0
  As  As15  1  0.000  0.250  0.500  1.0
  As  As16  1  0.250  0.500  0.000  1.0
  As  As17  1  0.000  0.750  0.500  1.0
  As  As18  1  0.500  0.000  0.750  1.0
  As  As19  1  0.750  0.500  0.000  1.0
  Cl  Cl20  1  0.500  0.500  0.500  1.0
  Cl  Cl21  1  0.000  0.000  0.000  1.0
  O  O22  1  0.094  0.364  0.643  1.0
  O  O23  1  0.594  0.857  0.136  1.0
  O  O24  1  0.136  0.406  0.143  1.0
  O  O25  1  0.143  0.136  0.406  1.0
  O  O26  1  0.357  0.906  0.364  1.0
  O  O27  1  0.864  0.594  0.143  1.0
  O  O28  1  0.864  0.406  0.857  1.0
  O  O29  1  0.357  0.094  0.636  1.0
  O  O30  1  0.857  0.864  0.406  1.0
  O  O31  1  0.906  0.364  0.357  1.0
  O  O32  1  0.136  0.594  0.857  1.0
  O  O33  1  0.364  0.357  0.906  1.0
  O  O34  1  0.406  0.143  0.136  1.0
  O  O35  1  0.906  0.636  0.643  1.0
  O  O36  1  0.406  0.857  0.864  1.0
  O  O37  1  0.643  0.094  0.364  1.0
  O  O38  1  0.636  0.357  0.094  1.0
  O  O39  1  0.857  0.136  0.594  1.0
  O  O40  1  0.643  0.906  0.636  1.0
  O  O41  1  0.636  0.643  0.906  1.0
  O  O42  1  0.594  0.143  0.864  1.0
  O  O43  1  0.094  0.636  0.357  1.0
  O  O44  1  0.364  0.643  0.094  1.0
  O  O45  1  0.143  0.864  0.594  1.0
[/CIF]
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