# generated using pymatgen
data_Zr2CuSi4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.62650426
_cell_length_b   16.62650426
_cell_length_c   3.68265000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   167.19675201
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2CuSi4
_chemical_formula_sum   'Zr4 Cu2 Si8'
_cell_volume   225.60020939
_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
  Zr  Zr0  1  0.67605900  0.32394100  0.75000000  1.0
  Zr  Zr1  1  0.32394100  0.67605900  0.25000000  1.0
  Zr  Zr2  1  0.95338000  0.04662000  0.75000000  1.0
  Zr  Zr3  1  0.04662000  0.95338000  0.25000000  1.0
  Cu  Cu4  1  0.25008100  0.74991900  0.75000000  1.0
  Cu  Cu5  1  0.74991900  0.25008100  0.25000000  1.0
  Si  Si6  1  0.52386700  0.47613300  0.75000000  1.0
  Si  Si7  1  0.47613300  0.52386700  0.25000000  1.0
  Si  Si8  1  0.38817400  0.61182600  0.75000000  1.0
  Si  Si9  1  0.61182600  0.38817400  0.25000000  1.0
  Si  Si10  1  0.11213700  0.88786300  0.75000000  1.0
  Si  Si11  1  0.88786300  0.11213700  0.25000000  1.0
  Si  Si12  1  0.79711200  0.20288800  0.75000000  1.0
  Si  Si13  1  0.20288800  0.79711200  0.25000000  1.0