# generated using pymatgen
data_Zr3(CuSi)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92810485
_cell_length_b   6.36160577
_cell_length_c   7.52624214
_cell_angle_alpha   115.00265899
_cell_angle_beta   105.09630502
_cell_angle_gamma   90.00160276
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3(CuSi)4
_chemical_formula_sum   'Zr3 Cu4 Si4'
_cell_volume   163.25855920
_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  0.87489238  0.87494617  0.74968760  1.0
  Zr  Zr1  1  0.12510762  0.12505483  0.25031240  1.0
  Zr  Zr2  1  -0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu3  1  0.33132523  0.52261011  0.66083027  1.0
  Cu  Cu4  1  0.66880036  0.86099804  0.33838306  1.0
  Cu  Cu5  1  0.33119964  0.13900196  0.66161694  1.0
  Cu  Cu6  1  0.66867477  0.47738889  0.33916973  1.0
  Si  Si7  1  0.49987447  0.80899056  -0.00017620  1.0
  Si  Si8  1  0.50012553  0.19100944  1.00017620  1.0
  Si  Si9  1  0.78496304  0.28439998  0.56907554  1.0
  Si  Si10  1  0.21503696  0.71560002  0.43092446  1.0