# generated using pymatgen
data_Nd12Ga2I17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.93317330
_cell_length_b   11.76488643
_cell_length_c   11.71589427
_cell_angle_alpha   73.46277443
_cell_angle_beta   74.96024897
_cell_angle_gamma   65.81299624
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd12Ga2I17
_chemical_formula_sum   'Nd12 Ga2 I17'
_cell_volume   1181.20707296
_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  0.46139451  0.47342585  0.33317404  1.0
  Nd  Nd1  1  0.56237119  0.66259673  0.99197880  1.0
  Nd  Nd2  1  0.28612734  0.00108292  0.08749007  1.0
  Nd  Nd3  1  0.86743690  0.29191529  0.85660776  1.0
  Nd  Nd4  1  0.38656424  0.23808345  0.72062637  1.0
  Nd  Nd5  1  0.71387266  0.99891708  0.91250993  1.0
  Nd  Nd6  1  0.53860549  0.52657415  0.66682596  1.0
  Nd  Nd7  1  0.43762881  0.33740327  0.00802120  1.0
  Nd  Nd8  1  0.61343576  0.76191655  0.27937363  1.0
  Nd  Nd9  1  0.82154578  0.18664133  0.57348644  1.0
  Nd  Nd10  1  0.17845422  0.81335867  0.42651356  1.0
  Nd  Nd11  1  0.13256310  0.70808471  0.14339224  1.0
  Ga  Ga12  1  0.37099955  0.73732658  0.21125590  1.0
  Ga  Ga13  1  0.62900045  0.26267342  0.78874410  1.0
  I  I14  1  0.05350330  0.10763510  0.31738792  1.0
  I  I15  1  0.46909408  0.94143321  0.82462118  1.0
  I  I16  1  0.42969513  0.83378519  0.53374850  1.0
  I  I17  1  0.57030487  0.16621481  0.46625150  1.0
  I  I18  1  0.85446888  0.68649476  0.04140372  1.0
  I  I19  1  0.21030077  0.41484296  0.26189635  1.0
  I  I20  1  0.69567337  0.36246414  0.11212759  1.0
  I  I21  1  0.53090592  0.05856679  0.17537882  1.0
  I  I22  1  0.75507260  0.47139199  0.41326496  1.0
  I  I23  1  0.89065687  0.78971600  0.37052516  1.0
  I  I24  1  0.94649670  0.89236490  0.68261208  1.0
  I  I25  1  0.14553112  0.31350524  0.95859628  1.0
  I  I26  1  0.30432663  0.63753586  0.88787241  1.0
  I  I27  1  0.00000000  0.00000000  0.00000000  1.0
  I  I28  1  0.10934313  0.21028400  0.62947484  1.0
  I  I29  1  0.78969923  0.58515704  0.73810365  1.0
  I  I30  1  0.24492740  0.52860801  0.58673504  1.0