# generated using pymatgen
data_Zr3Sc5(Nb3Si4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69417244
_cell_length_b   6.89855383
_cell_length_c   13.12454130
_cell_angle_alpha   89.97569453
_cell_angle_beta   89.94576780
_cell_angle_gamma   89.97735582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Sc5(Nb3Si4)4
_chemical_formula_sum   'Zr3 Sc5 Nb12 Si16'
_cell_volume   606.09237381
_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
  Zr  Zr0  1  0.50282812  0.67542263  0.59673576  1.0
  Zr  Zr1  1  0.00217128  0.82523675  0.90308111  1.0
  Zr  Zr2  1  0.49706649  0.32519318  0.09724665  1.0
  Sc  Sc3  1  0.99887909  0.17384794  0.40456184  1.0
  Sc  Sc4  1  0.49869150  0.32754088  0.40473908  1.0
  Sc  Sc5  1  0.00010721  0.17300523  0.09526067  1.0
  Sc  Sc6  1  0.49911855  0.67284049  0.90493833  1.0
  Sc  Sc7  1  0.99981976  0.82641019  0.59522074  1.0
  Nb  Nb8  1  0.66310821  0.17500831  0.62386280  1.0
  Nb  Nb9  1  0.16301020  0.32520394  0.87609226  1.0
  Nb  Nb10  1  0.33696842  0.82499728  0.12367511  1.0
  Nb  Nb11  1  0.83587698  0.67548662  0.37564462  1.0
  Nb  Nb12  1  0.33716450  0.82394405  0.37541061  1.0
  Nb  Nb13  1  0.83614133  0.67439762  0.12401408  1.0
  Nb  Nb14  1  0.66402379  0.17440143  0.87559681  1.0
  Nb  Nb15  1  0.16480282  0.32666589  0.62451241  1.0
  Nb  Nb16  1  0.83754570  0.49586984  0.75088569  1.0
  Nb  Nb17  1  0.33793852  0.00449878  0.74935979  1.0
  Nb  Nb18  1  0.16267871  0.50532751  0.24962539  1.0
  Nb  Nb19  1  0.66205848  0.99550953  0.24888738  1.0
  Si  Si20  1  0.66775725  0.96771381  0.46086704  1.0
  Si  Si21  1  0.16769490  0.53362447  0.03858355  1.0
  Si  Si22  1  0.33189193  0.03406109  0.96156314  1.0
  Si  Si23  1  0.83235963  0.46609770  0.53840617  1.0
  Si  Si24  1  0.33147862  0.03419052  0.53849134  1.0
  Si  Si25  1  0.83020999  0.46536814  0.96175588  1.0
  Si  Si26  1  0.66939101  0.96565275  0.03846003  1.0
  Si  Si27  1  0.16829651  0.53310054  0.46106423  1.0
  Si  Si28  1  0.46033297  0.38609915  0.75027233  1.0
  Si  Si29  1  0.96044163  0.11447173  0.74917377  1.0
  Si  Si30  1  0.54043077  0.61359955  0.25003178  1.0
  Si  Si31  1  0.03976024  0.88608786  0.24997523  1.0
  Si  Si32  1  0.70586616  0.86529612  0.75008581  1.0
  Si  Si33  1  0.20575671  0.63510255  0.74969403  1.0
  Si  Si34  1  0.29284203  0.13487110  0.25116644  1.0
  Si  Si35  1  0.79549100  0.36385683  0.25105909  1.0