# generated using pymatgen
data_Zr3Mn8NiP6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58418382
_cell_length_b   10.67586955
_cell_length_c   12.48345036
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Mn8NiP6
_chemical_formula_sum   'Zr6 Mn16 Ni2 P12'
_cell_volume   477.67022676
_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
  Zr  Zr0  1  0.75198017  0.00000000  0.46588962  1.0
  Zr  Zr1  1  0.25198017  0.50000000  0.53411038  1.0
  Zr  Zr2  1  0.25184106  0.67586656  0.79525664  1.0
  Zr  Zr3  1  0.25184106  0.32413344  0.79525664  1.0
  Zr  Zr4  1  0.75184106  0.82413344  0.20474336  1.0
  Zr  Zr5  1  0.75184106  0.17586656  0.20474336  1.0
  Mn  Mn6  1  0.75123289  0.00000000  0.00682847  1.0
  Mn  Mn7  1  0.25123289  0.50000000  0.99317153  1.0
  Mn  Mn8  1  0.25162840  0.20518174  0.56238553  1.0
  Mn  Mn9  1  0.25162840  0.79481826  0.56238553  1.0
  Mn  Mn10  1  0.75162840  0.29481826  0.43761447  1.0
  Mn  Mn11  1  0.75162840  0.70518174  0.43761447  1.0
  Mn  Mn12  1  0.25205347  0.62487996  0.30597414  1.0
  Mn  Mn13  1  0.25205347  0.37512004  0.30597414  1.0
  Mn  Mn14  1  0.75205347  0.87512004  0.69402586  1.0
  Mn  Mn15  1  0.75205347  0.12487996  0.69402586  1.0
  Mn  Mn16  1  0.25137635  0.16785701  0.00329801  1.0
  Mn  Mn17  1  0.25137635  0.83214299  0.00329801  1.0
  Mn  Mn18  1  0.75137635  0.33214299  0.99670199  1.0
  Mn  Mn19  1  0.75137635  0.66785701  0.99670199  1.0
  Mn  Mn20  1  0.25225699  0.00000000  0.82815338  1.0
  Mn  Mn21  1  0.75225699  0.50000000  0.17184662  1.0
  Ni  Ni22  1  0.25306968  0.00000000  0.29377677  1.0
  Ni  Ni23  1  0.75306968  0.50000000  0.70622323  1.0
  P  P24  1  0.25178840  0.17473516  0.37820755  1.0
  P  P25  1  0.25178840  0.82526484  0.37820755  1.0
  P  P26  1  0.75178840  0.32526484  0.62179245  1.0
  P  P27  1  0.75178840  0.67473516  0.62179245  1.0
  P  P28  1  0.25151091  0.00000000  0.12270409  1.0
  P  P29  1  0.75151091  0.50000000  0.87729591  1.0
  P  P30  1  0.25167013  0.65917459  0.11940367  1.0
  P  P31  1  0.25167013  0.34082541  0.11940367  1.0
  P  P32  1  0.75167013  0.84082541  0.88059633  1.0
  P  P33  1  0.75167013  0.15917459  0.88059633  1.0
  P  P34  1  0.25203673  0.00000000  0.63158265  1.0
  P  P35  1  0.75203673  0.50000000  0.36841735  1.0