# generated using pymatgen
data_Sc4Ni5P6Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66268435
_cell_length_b   10.06929312
_cell_length_c   12.25271610
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4Ni5P6Os
_chemical_formula_sum   'Sc8 Ni10 P12 Os2'
_cell_volume   451.88804019
_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
  Sc  Sc0  1  0.25000000  0.34094094  0.99682208  1.0
  Sc  Sc1  1  0.25000000  0.15905906  0.49682208  1.0
  Sc  Sc2  1  0.75000000  0.65388291  0.00264296  1.0
  Sc  Sc3  1  0.75000000  0.84611709  0.50264296  1.0
  Sc  Sc4  1  0.25000000  0.42714802  0.71227612  1.0
  Sc  Sc5  1  0.25000000  0.07285198  0.21227612  1.0
  Sc  Sc6  1  0.75000000  0.56765064  0.28552104  1.0
  Sc  Sc7  1  0.75000000  0.93234936  0.78552104  1.0
  Ni  Ni8  1  0.75000000  0.09825125  0.02093186  1.0
  Ni  Ni9  1  0.75000000  0.40174875  0.52093186  1.0
  Ni  Ni10  1  0.25000000  0.13703071  0.71662048  1.0
  Ni  Ni11  1  0.25000000  0.36296929  0.21662048  1.0
  Ni  Ni12  1  0.75000000  0.86887924  0.28146402  1.0
  Ni  Ni13  1  0.75000000  0.63112076  0.78146402  1.0
  Ni  Ni14  1  0.25000000  0.76569130  0.16912091  1.0
  Ni  Ni15  1  0.25000000  0.73430870  0.66912091  1.0
  Ni  Ni16  1  0.75000000  0.22393367  0.83570979  1.0
  Ni  Ni17  1  0.75000000  0.27606633  0.33570979  1.0
  P  P18  1  0.25000000  0.10603585  0.89521673  1.0
  P  P19  1  0.25000000  0.39396415  0.39521673  1.0
  P  P20  1  0.75000000  0.89686536  0.10238831  1.0
  P  P21  1  0.75000000  0.60313464  0.60238831  1.0
  P  P22  1  0.25000000  0.73694651  0.84994827  1.0
  P  P23  1  0.25000000  0.76305349  0.34994827  1.0
  P  P24  1  0.75000000  0.26138481  0.14808873  1.0
  P  P25  1  0.75000000  0.23861519  0.64808873  1.0
  P  P26  1  0.25000000  0.55272970  0.12706108  1.0
  P  P27  1  0.25000000  0.94727030  0.62706108  1.0
  P  P28  1  0.75000000  0.44224014  0.87286273  1.0
  P  P29  1  0.75000000  0.05775986  0.37286273  1.0
  Os  Os30  1  0.25000000  0.90299249  0.98332388  1.0
  Os  Os31  1  0.25000000  0.59700751  0.48332388  1.0