# generated using pymatgen
data_Zr2Ni12P7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.99908811
_cell_length_b   8.99908811
_cell_length_c   3.58738478
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni12P7
_chemical_formula_sum   'Zr2 Ni12 P7'
_cell_volume   251.59708262
_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  0.00000000  0.00000000  0.00000000  1
  Zr  Zr1  1  0.33333300  0.66666700  0.50000000  1
  Ni  Ni2  1  0.29423300  0.39416000  0.00000000  1
  Ni  Ni3  1  0.88567600  0.46154700  0.50000000  1
  Ni  Ni4  1  0.09992700  0.70576700  0.00000000  1
  Ni  Ni5  1  0.53845300  0.42413000  0.50000000  1
  Ni  Ni6  1  0.39000400  0.17555100  0.00000000  1
  Ni  Ni7  1  0.78554700  0.60999600  0.00000000  1
  Ni  Ni8  1  0.82444900  0.21445300  0.00000000  1
  Ni  Ni9  1  0.23196900  0.94548300  0.50000000  1
  Ni  Ni10  1  0.05451700  0.28648600  0.50000000  1
  Ni  Ni11  1  0.71351400  0.76803100  0.50000000  1
  Ni  Ni12  1  0.57587000  0.11432400  0.50000000  1
  Ni  Ni13  1  0.60584000  0.90007300  0.00000000  1
  P  P14  1  0.66666700  0.33333300  0.00000000  1
  P  P15  1  0.07951600  0.45259900  0.00000000  1
  P  P16  1  0.25582400  0.21346200  0.50000000  1
  P  P17  1  0.78653800  0.04236200  0.50000000  1
  P  P18  1  0.95763800  0.74417600  0.50000000  1
  P  P19  1  0.54740100  0.62691700  0.00000000  1
  P  P20  1  0.37308300  0.92048400  0.00000000  1
