data_[Ca4Ga8Mo4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Ga  1.8100  1.3000  0.7600
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.7750]
_cell_length_b [9.6972]
_cell_length_c [5.4899]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.7736]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CaGa2MoO6]
_chemical_formula_sum '[Ca4 Ga8 Mo4 O24]'
_cell_volume [514.2957]
_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
[
  Ca  Ca0  4  0.0000  0.0899  0.2500  1.0
  Ga  Ga1  8  0.1878  0.4086  0.2982  1.0
  Mo  Mo2  4  0.0000  0.2779  0.7500  1.0
  O  O3  8  0.1058  0.2724  0.0919  1.0
  O  O4  8  0.1208  0.1116  0.6455  1.0
  O  O5  8  0.1392  0.4243  0.6221  1.0
]