# generated using pymatgen
data_Ca3Al2Ga3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89777196
_cell_length_b   5.89777250
_cell_length_c   14.86402132
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   135.32999529
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Al2Ga3
_chemical_formula_sum   'Ca6 Al4 Ga6'
_cell_volume   363.48084652
_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
  Ca  Ca0  1  0.87025553  0.12974447  0.75000000  1.0
  Ca  Ca1  1  0.12974447  0.87025553  0.25000000  1.0
  Ca  Ca2  1  0.41523417  0.58476583  0.11113480  1.0
  Ca  Ca3  1  0.58476583  0.41523417  0.88886520  1.0
  Ca  Ca4  1  0.58476583  0.41523417  0.61113480  1.0
  Ca  Ca5  1  0.41523417  0.58476583  0.38886520  1.0
  Al  Al6  1  0.71153112  0.28846888  0.40593119  1.0
  Al  Al7  1  0.28846888  0.71153112  0.59406881  1.0
  Al  Al8  1  0.28846888  0.71153112  0.90593119  1.0
  Al  Al9  1  0.71153112  0.28846888  0.09406881  1.0
  Ga  Ga10  1  0.16860795  0.83139205  0.75000000  1.0
  Ga  Ga11  1  0.83139205  0.16860795  0.25000000  1.0
  Ga  Ga12  1  0.88776078  0.11223922  0.53516786  1.0
  Ga  Ga13  1  0.11223922  0.88776078  0.46483214  1.0
  Ga  Ga14  1  0.11223922  0.88776078  0.03516786  1.0
  Ga  Ga15  1  0.88776078  0.11223922  0.96483214  1.0