# generated using pymatgen
data_Zr6ZnP5Ru6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53121912
_cell_length_b   7.53605866
_cell_length_c   7.53122002
_cell_angle_alpha   128.74237270
_cell_angle_beta   119.92828750
_cell_angle_gamma   82.81594400
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6ZnP5Ru6
_chemical_formula_sum   'Zr6 Zn1 P5 Ru6'
_cell_volume   277.63423952
_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  0.45059689  0.65550230  0.70490541  1.0
  Zr  Zr1  1  0.53054789  0.25111679  0.22056891  1.0
  Zr  Zr2  1  0.74959258  0.83226902  0.58267645  1.0
  Zr  Zr3  1  0.24949591  0.83301660  0.08351969  1.0
  Zr  Zr4  1  0.05116040  0.25141129  0.70025190  1.0
  Zr  Zr5  1  0.96778684  0.68775621  0.21996837  1.0
  Zn  Zn6  1  0.25296732  0.23239231  0.47942599  1.0
  P  P7  1  0.74909750  0.28390763  0.03481013  1.0
  P  P8  1  0.33302591  0.58592816  0.25249716  1.0
  P  P9  1  0.66681838  0.91935141  0.25368969  1.0
  P  P10  1  0.16566171  0.91935141  0.75253303  1.0
  P  P11  1  0.83343100  0.58592816  0.75290225  1.0
  Ru  Ru12  1  0.49745974  0.50194918  0.99973422  1.0
  Ru  Ru13  1  0.00221595  0.50194918  0.50449143  1.0
  Ru  Ru14  1  0.09054276  0.25388448  0.09455169  1.0
  Ru  Ru15  1  0.84514385  0.00500070  0.09987911  1.0
  Ru  Ru16  1  0.40512159  0.00500070  0.65985785  1.0
  Ru  Ru17  1  0.65933279  0.25388448  0.66334172  1.0