# generated using pymatgen
data_Ni16GeP5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58097621
_cell_length_b   6.65841132
_cell_length_c   6.74945347
_cell_angle_alpha   98.64316688
_cell_angle_beta   102.53516221
_cell_angle_gamma   119.23581725
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni16GeP5
_chemical_formula_sum   'Ni16 Ge1 P5'
_cell_volume   240.25472181
_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
  Ni  Ni0  1  0.27870600  0.64534500  0.29758700  1
  Ni  Ni1  1  0.72129400  0.35465500  0.70241300  1
  Ni  Ni2  1  0.58568500  0.72878600  0.10645500  1
  Ni  Ni3  1  0.41431500  0.27121400  0.89354500  1
  Ni  Ni4  1  0.55517200  0.44438100  0.33552500  1
  Ni  Ni5  1  0.44482800  0.55561900  0.66447500  1
  Ni  Ni6  1  0.61370600  0.08367100  0.35107100  1
  Ni  Ni7  1  0.38629400  0.91632900  0.64892900  1
  Ni  Ni8  1  0.20606200  0.00416000  0.10331200  1
  Ni  Ni9  1  0.79393800  0.99584000  0.89668800  1
  Ni  Ni10  1  0.04467700  0.20418700  0.29903300  1
  Ni  Ni11  1  0.95532300  0.79581300  0.70096700  1
  Ni  Ni12  1  0.82618100  0.37504700  0.10201800  1
  Ni  Ni13  1  0.17381900  0.62495300  0.89798200  1
  Ni  Ni14  1  0.01791100  0.19724000  0.66268400  1
  Ni  Ni15  1  0.98208900  0.80276000  0.33731600  1
  Ge  Ge16  1  -0.00000000  0.50000000  0.50000000  1
  P  P17  1  0.17352200  0.33581000  0.03251500  1
  P  P18  1  0.82647800  0.66419000  0.96748500  1
  P  P19  1  0.33034800  0.16927300  0.49913400  1
  P  P20  1  0.66965200  0.83072700  0.50086600  1
  P  P21  1  0.50000000  0.00000000  0.00000000  1
