data_Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86
_cell_length_b   7.86
_cell_length_c   7.86
_cell_angle_alpha   71.18
_cell_angle_beta   71.18
_cell_angle_gamma   71.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga
_chemical_formula_sum   Ga22
_cell_volume   421.11
_cell_formula_units_Z   22
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
  Ga  Ga0  1  0.6  0.81  0.36  1.0
  Ga  Ga1  1  0.4  0.19  0.09  1.0
  Ga  Ga2  1  0.81  0.84  0.95  1.0
  Ga  Ga3  1  0.63  0.37  0.7  1.0
  Ga  Ga4  1  0.19  0.16  0.5  1.0
  Ga  Ga5  1  0.37  0.63  0.75  1.0
  Ga  Ga6  1  0.0  0.39  0.36  1.0
  Ga  Ga7  1  0.6  0.19  0.09  1.0
  Ga  Ga8  1  0.81  0.16  0.5  1.0
  Ga  Ga9  1  0.37  0.37  0.7  1.0
  Ga  Ga10  1  0.0  0.74  0.75  1.0
  Ga  Ga11  1  0.0  0.61  0.09  1.0
  Ga  Ga12  1  0.29  0.68  0.82  1.0
  Ga  Ga13  1  0.4  0.81  0.36  1.0
  Ga  Ga14  1  0.19  0.84  0.95  1.0
  Ga  Ga15  1  0.0  0.68  0.5  1.0
  Ga  Ga16  1  0.0  0.64  0.82  1.0
  Ga  Ga17  1  0.0  0.26  0.7  1.0
  Ga  Ga18  1  0.63  0.63  0.75  1.0
  Ga  Ga19  1  0.0  0.0  0.0  1.0
  Ga  Ga20  1  0.0  0.32  0.95  1.0
  Ga  Ga21  1  0.71  0.68  0.82  1.0

data_Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.86
_cell_length_b   7.86
_cell_length_c   7.86
_cell_angle_alpha   71.18
_cell_angle_beta   71.18
_cell_angle_gamma   71.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga
_chemical_formula_sum   Ga22
_cell_volume   421.11
_cell_formula_units_Z   22
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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Ga  Ga1  1  0.16  0.19  0.05  1.0
  Ga  Ga2  1  0.16  0.81  0.05  1.0
  Ga  Ga3  1  0.19  0.4  0.64  1.0
  Ga  Ga4  1  0.19  0.6  0.64  1.0
  Ga  Ga5  1  0.26  0.0  0.25  1.0
  Ga  Ga6  1  0.32  0.0  0.5  1.0
  Ga  Ga7  1  0.32  0.29  0.18  1.0
  Ga  Ga8  1  0.32  0.71  0.18  1.0
  Ga  Ga9  1  0.36  0.0  0.18  1.0
  Ga  Ga10  1  0.37  0.37  0.25  1.0
  Ga  Ga11  1  0.37  0.63  0.25  1.0
  Ga  Ga12  1  0.39  0.0  0.91  1.0
  Ga  Ga13  1  0.61  -0.0  0.64  1.0
  Ga  Ga14  1  0.63  0.37  0.3  1.0
  Ga  Ga15  1  0.63  0.63  0.3  1.0
  Ga  Ga16  1  0.68  -0.0  0.05  1.0
  Ga  Ga17  1  0.74  -0.0  0.3  1.0
  Ga  Ga18  1  0.81  0.4  0.91  1.0
  Ga  Ga19  1  0.81  0.6  0.91  1.0
  Ga  Ga20  1  0.84  0.19  0.5  1.0
  Ga  Ga21  1  0.84  0.81  0.5  1.0

Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga Ga
Ga crystallizes in the triclinic P1 space group. There are twenty-two inequivalent Ga sites. In the first Ga site, Ga(1) is bonded in a single-bond geometry to one Ga(14) and one Ga(3) atom. The Ga(1)-Ga(14) bond length is 1.61 Å. The Ga(1)-Ga(3) bond length is 3.09 Å. In the second Ga site, Ga(2) is bonded in a single-bond geometry to one Ga(8) atom. The Ga(2)-Ga(8) bond length is 1.61 Å. In the third Ga site, Ga(3) is bonded in a 7-coordinate geometry to one Ga(1), one Ga(11), one Ga(12), one Ga(17), one Ga(20), one Ga(22), and one Ga(8) atom. The Ga(3)-Ga(11) bond length is 1.98 Å. The Ga(3)-Ga(12) bond length is 2.14 Å. The Ga(3)-Ga(17) bond length is 2.09 Å. The Ga(3)-Ga(20) bond length is 2.39 Å. The Ga(3)-Ga(22) bond length is 2.31 Å. The Ga(3)-Ga(8) bond length is 3.05 Å. In the fourth Ga site, Ga(4) is bonded in a 6-coordinate geometry to one Ga(10), one Ga(18), one Ga(19), one Ga(6), one Ga(8), and one Ga(9) atom. The Ga(4)-Ga(10) bond length is 2.03 Å. The Ga(4)-Ga(18) bond length is 2.76 Å. The Ga(4)-Ga(19) bond length is 2.21 Å. The Ga(4)-Ga(6) bond length is 2.41 Å. The Ga(4)-Ga(8) bond length is 2.86 Å. The Ga(4)-Ga(9) bond length is 2.45 Å. In the fifth Ga site, Ga(5) is bonded in a 2-coordinate geometry to one Ga(18) and one Ga(7) atom. The Ga(5)-Ga(18) bond length is 1.98 Å. The Ga(5)-Ga(7) bond length is 2.14 Å. In the sixth Ga site, Ga(6) is bonded in a distorted single-bond geometry to one Ga(10), one Ga(13), one Ga(19), and one Ga(4) atom. The Ga(6)-Ga(10) bond length is 2.21 Å. The Ga(6)-Ga(13) bond length is 0.78 Å. The Ga(6)-Ga(19) bond length is 2.03 Å. In the seventh Ga site, Ga(7) is bonded in a 5-coordinate geometry to one Ga(12), one Ga(16), one Ga(18), one Ga(5), and one Ga(9) atom. The Ga(7)-Ga(12) bond length is 2.33 Å. The Ga(7)-Ga(16) bond length is 2.84 Å. The Ga(7)-Ga(18) bond length is 2.51 Å. The Ga(7)-Ga(9) bond length is 2.44 Å. In the eighth Ga site, Ga(8) is bonded in a distorted single-bond geometry to one Ga(2), one Ga(3), and one Ga(4) atom. In the ninth Ga site, Ga(9) is bonded in a distorted L-shaped geometry to one Ga(4) and one Ga(7) atom. In the tenth Ga site, Ga(10) is bonded in a 2-coordinate geometry to one Ga(4) and one Ga(6) atom. In the eleventh Ga site, Ga(11) is bonded in a single-bond geometry to one Ga(16), one Ga(17), and one Ga(3) atom. The Ga(11)-Ga(16) bond length is 2.16 Å. The Ga(11)-Ga(17) bond length is 0.78 Å. In the twelfth Ga site, Ga(12) is bonded in a 6-coordinate geometry to one Ga(13), one Ga(15), one Ga(17), one Ga(21), one Ga(3), and one Ga(7) atom. The Ga(12)-Ga(13) bond length is 2.60 Å. The Ga(12)-Ga(15) bond length is 2.44 Å. The Ga(12)-Ga(17) bond length is 2.07 Å. The Ga(12)-Ga(21) bond length is 2.84 Å. In the thirteenth Ga site, Ga(13) is bonded in a distorted single-bond geometry to one Ga(12), one Ga(15), and one Ga(6) atom. The Ga(13)-Ga(15) bond length is 1.74 Å. In the fourteenth Ga site, Ga(14) is bonded in a distorted single-bond geometry to one Ga(1) atom. In the fifteenth Ga site, Ga(15) is bonded in a 2-coordinate geometry to one Ga(12), one Ga(13), and one Ga(20) atom. The Ga(15)-Ga(20) bond length is 1.62 Å. In the sixteenth Ga site, Ga(16) is bonded in a 1-coordinate geometry to one Ga(11) and one Ga(7) atom. In the seventeenth Ga site, Ga(17) is bonded in a single-bond geometry to one Ga(11), one Ga(12), one Ga(21), and one Ga(3) atom. The Ga(17)-Ga(21) bond length is 2.39 Å. In the eighteenth Ga site, Ga(18) is bonded in a 2-coordinate geometry to one Ga(21), one Ga(4), one Ga(5), and one Ga(7) atom. The Ga(18)-Ga(21) bond length is 2.16 Å. In the nineteenth Ga site, Ga(19) is bonded in a 3-coordinate geometry to one Ga(22), one Ga(4), and one Ga(6) atom. The Ga(19)-Ga(22) bond length is 1.19 Å. In the twentieth Ga site, Ga(20) is bonded in a 1-coordinate geometry to one Ga(15), one Ga(21), and one Ga(3) atom. The Ga(20)-Ga(21) bond length is 2.41 Å. In the twenty-first Ga site, Ga(21) is bonded in a 3-coordinate geometry to one Ga(12), one Ga(17), one Ga(18), and one Ga(20) atom. In the twenty-second Ga site, Ga(22) is bonded in a distorted single-bond geometry to one Ga(19) and one Ga(3) atom.