data_Mn2GaCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.96
_cell_length_b   2.96
_cell_length_c   7.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2GaCl
_chemical_formula_sum   'Mn2 Ga1 Cl1'
_cell_volume   63.6
_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
  Mn  Mn2  1  0.48  0.48  0.34  1.0
  Mn  Mn3  1  0.48  0.48  0.94  1.0
  Ga  Ga1  1  0.0  0.0  0.64  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_Mn2GaCl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.18
_cell_length_b   4.18
_cell_length_c   7.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Mn2GaCl
_chemical_formula_sum   'Mn4 Ga2 Cl2'
_cell_volume   127.2
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Mn  Mn0  2  0.48  0.0  0.34  1.0
  Mn  Mn1  2  0.48  0.0  0.94  1.0
  Ga  Ga2  2  0.0  0.0  0.64  1.0
  Cl  Cl3  2  0.0  0.0  0.0  1.0

Mn Mn Ga Cl
Mn2GaCl crystallizes in the monoclinic Cm space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 13-coordinate geometry to one Mn(2), four equivalent Mn(1), four equivalent Ga(1), and four equivalent Cl(1) atoms. The Mn(1)-Mn(2) bond length is 2.93 Å. All Mn(1)-Mn(1) bond lengths are 2.96 Å. There are a spread of Mn(1)-Ga(1) bond distances ranging from 2.95-3.08 Å. There are a spread of Mn(1)-Cl(1) bond distances ranging from 3.18-3.30 Å. In the second Mn site, Mn(2) is bonded in a distorted square co-planar geometry to one Mn(1) and four equivalent Cl(1) atoms. There are a spread of Mn(2)-Cl(1) bond distances ranging from 2.05-2.23 Å. Ga(1) is bonded in a distorted single-bond geometry to four equivalent Mn(1) and one Cl(1) atom. The Ga(1)-Cl(1) bond length is 2.63 Å. Cl(1) is bonded in a 4-coordinate geometry to four equivalent Mn(1), four equivalent Mn(2), and one Ga(1) atom.