# generated using pymatgen
data_ZrScFe12P7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.93151050
_cell_length_b   8.93151057
_cell_length_c   3.57259235
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999216
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScFe12P7
_chemical_formula_sum   'Zr1 Sc1 Fe12 P7'
_cell_volume   246.81068673
_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  1.0
  Sc  Sc1  1  0.33333300  0.66666700  0.50000000  1.0
  Fe  Fe2  1  0.10122915  0.38905947  0.00000000  1.0
  Fe  Fe3  1  0.28783131  0.89877085  0.00000000  1.0
  Fe  Fe4  1  0.61094053  0.71216869  0.00000000  1.0
  Fe  Fe5  1  0.83177190  0.61721267  0.00000000  1.0
  Fe  Fe6  1  0.78544077  0.16822810  0.00000000  1.0
  Fe  Fe7  1  0.38278733  0.21455923  0.00000000  1.0
  Fe  Fe8  1  0.04450084  0.76203887  0.50000000  1.0
  Fe  Fe9  1  0.71754102  0.95549916  0.50000000  1.0
  Fe  Fe10  1  0.23796113  0.28245898  0.50000000  1.0
  Fe  Fe11  1  0.88726041  0.42521100  0.50000000  1.0
  Fe  Fe12  1  0.53795059  0.11273959  0.50000000  1.0
  Fe  Fe13  1  0.57478900  0.46204941  0.50000000  1.0
  P  P14  1  0.08521211  0.62404312  0.00000000  1.0
  P  P15  1  0.53883001  0.91478789  0.00000000  1.0
  P  P16  1  0.37595688  0.46116999  0.00000000  1.0
  P  P17  1  0.77741927  0.74343589  0.50000000  1.0
  P  P18  1  0.96601563  0.22258073  0.50000000  1.0
  P  P19  1  0.25656411  0.03398437  0.50000000  1.0
  P  P20  1  0.66666700  0.33333300  0.00000000  1.0