# generated using pymatgen
data_ZrScMnNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94620078
_cell_length_b   4.94620078
_cell_length_c   12.07796058
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScMnNi3
_chemical_formula_sum   'Zr3 Sc3 Mn3 Ni9'
_cell_volume   255.89848971
_cell_formula_units_Z   3
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  0.33333300  0.66666700  0.66633000  1
  Zr  Zr1  1  0.00000000  0.00000000  0.99966300  1
  Zr  Zr2  1  0.66666700  0.33333300  0.33299600  1
  Sc  Sc3  1  0.33333300  0.66666700  0.91684900  1
  Sc  Sc4  1  0.00000000  0.00000000  0.25018200  1
  Sc  Sc5  1  0.66666700  0.33333300  0.58351500  1
  Mn  Mn6  1  0.33333300  0.66666700  0.29154100  1
  Mn  Mn7  1  0.00000000  0.00000000  0.62487500  1
  Mn  Mn8  1  0.66666700  0.33333300  0.95820800  1
  Ni  Ni9  1  0.00025100  0.50012600  0.12509300  1
  Ni  Ni10  1  0.49987400  0.50012600  0.12509300  1
  Ni  Ni11  1  0.49987400  0.99974900  0.12509300  1
  Ni  Ni12  1  0.66691800  0.83345900  0.45842700  1
  Ni  Ni13  1  0.16654100  0.83345900  0.45842700  1
  Ni  Ni14  1  0.16654100  0.33308200  0.45842700  1
  Ni  Ni15  1  0.33358400  0.16679200  0.79176000  1
  Ni  Ni16  1  0.83320800  0.16679200  0.79176000  1
  Ni  Ni17  1  0.83320800  0.66641600  0.79176000  1
