# generated using pymatgen
data_Nd12Ga(GeBr4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.40770978
_cell_length_b   10.40621249
_cell_length_c   10.40771031
_cell_angle_alpha   109.46830433
_cell_angle_beta   109.47413833
_cell_angle_gamma   109.46831241
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd12Ga(GeBr4)3
_chemical_formula_sum   'Nd12 Ga1 Ge3 Br12'
_cell_volume   867.75424255
_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
  Nd  Nd0  1  0.25978133  0.00978133  0.01956266  1.0
  Nd  Nd1  1  0.01931332  0.25965666  0.00965666  1.0
  Nd  Nd2  1  0.49034334  0.75000000  0.00965666  1.0
  Nd  Nd3  1  0.75067680  0.24120940  0.25934799  1.0
  Nd  Nd4  1  0.00867019  0.01813959  0.25934799  1.0
  Nd  Nd5  1  0.00867019  0.49053260  0.74932320  1.0
  Nd  Nd6  1  0.24065201  0.25879060  0.74932320  1.0
  Nd  Nd7  1  0.25978133  0.75000000  0.24021867  1.0
  Nd  Nd8  1  0.24065201  0.48186041  0.49132981  1.0
  Nd  Nd9  1  0.48043734  0.49021867  0.24021867  1.0
  Nd  Nd10  1  0.75067680  0.00946740  0.49132981  1.0
  Nd  Nd11  1  0.49034334  0.24034334  0.48068668  1.0
  Ga  Ga12  1  0.00000000  0.25000000  0.50000000  1.0
  Ge  Ge13  1  0.24977073  0.49977073  0.99954146  1.0
  Ge  Ge14  1  0.50045854  0.00022927  0.25022927  1.0
  Ge  Ge15  1  0.24977073  0.25000000  0.25022927  1.0
  Br  Br16  1  0.75483011  0.74375568  0.24958492  1.0
  Br  Br17  1  0.50509035  0.25000000  0.99490965  1.0
  Br  Br18  1  0.25041508  0.99417076  0.50524519  1.0
  Br  Br19  1  0.51177513  0.50588857  0.75588857  1.0
  Br  Br20  1  0.99475481  0.98892657  0.74516989  1.0
  Br  Br21  1  0.74411143  0.99411143  0.98822487  1.0
  Br  Br22  1  0.50509035  0.75509035  0.51018070  1.0
  Br  Br23  1  0.75483011  0.51107343  0.50524519  1.0
  Br  Br24  1  0.99475481  0.50582924  0.24958492  1.0
  Br  Br25  1  0.98981930  0.74490965  0.99490965  1.0
  Br  Br26  1  0.25041508  0.75624432  0.74516989  1.0
  Br  Br27  1  0.74411143  0.25000000  0.75588857  1.0