# generated using pymatgen
data_ErZr3(Nb3Si4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92074167
_cell_length_b   6.91747811
_cell_length_c   12.77656505
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.08981479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErZr3(Nb3Si4)2
_chemical_formula_sum   'Er2 Zr6 Nb12 Si16'
_cell_volume   611.66553285
_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
  Er  Er0  1  0.33934819  0.99794254  0.78122451  1.0
  Er  Er1  1  0.66065181  0.00205746  0.28122451  1.0
  Zr  Zr2  1  0.00380919  0.34367271  0.21675630  1.0
  Zr  Zr3  1  0.99619081  0.65632729  0.71675630  1.0
  Zr  Zr4  1  0.15913726  0.50225290  0.46833480  1.0
  Zr  Zr5  1  0.49789284  0.84088367  0.03306961  1.0
  Zr  Zr6  1  0.84086274  0.49774710  0.96833480  1.0
  Zr  Zr7  1  0.50210716  0.15911633  0.53306961  1.0
  Nb  Nb8  1  0.16945692  0.17085130  0.00034912  1.0
  Nb  Nb9  1  0.83054308  0.82914870  0.50034912  1.0
  Nb  Nb10  1  0.32710435  0.66827920  0.25020433  1.0
  Nb  Nb11  1  0.67289565  0.33172080  0.75020433  1.0
  Nb  Nb12  1  0.15147119  0.99495815  0.37691747  1.0
  Nb  Nb13  1  0.84852881  0.00504185  0.87691747  1.0
  Nb  Nb14  1  0.50628680  0.65211542  0.62560669  1.0
  Nb  Nb15  1  0.34927103  0.49664433  0.87432405  1.0
  Nb  Nb16  1  0.49371320  0.34788458  0.12560669  1.0
  Nb  Nb17  1  0.65072897  0.50335567  0.37432405  1.0
  Nb  Nb18  1  0.99742701  0.15481479  0.62275525  1.0
  Nb  Nb19  1  0.00257299  0.84518521  0.12275525  1.0
  Si  Si20  1  0.29345732  0.04524295  0.18698504  1.0
  Si  Si21  1  0.70654268  0.95475705  0.68698504  1.0
  Si  Si22  1  0.45397963  0.79729063  0.43761979  1.0
  Si  Si23  1  0.20224224  0.54545994  0.06258238  1.0
  Si  Si24  1  0.54602037  0.20270937  0.93761979  1.0
  Si  Si25  1  0.79775776  0.45454006  0.56258238  1.0
  Si  Si26  1  0.04601443  0.29936038  0.81302837  1.0
  Si  Si27  1  0.95398557  0.70063962  0.31302837  1.0
  Si  Si28  1  0.36140600  0.29322535  0.32218780  1.0
  Si  Si29  1  0.63859400  0.70677465  0.82218780  1.0
  Si  Si30  1  0.20742377  0.86388842  0.57090068  1.0
  Si  Si31  1  0.13321202  0.78936428  0.92978245  1.0
  Si  Si32  1  0.79257623  0.13611158  0.07090068  1.0
  Si  Si33  1  0.86678798  0.21063572  0.42978245  1.0
  Si  Si34  1  0.29253523  0.36781938  0.67737633  1.0
  Si  Si35  1  0.70746477  0.63218062  0.17737633  1.0