# generated using pymatgen
data_ZrMnSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15849615
_cell_length_b   7.88563986
_cell_length_c   17.31826068
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrMnSi2
_chemical_formula_sum   'Zr12 Mn12 Si24'
_cell_volume   704.47295017
_cell_formula_units_Z   12
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  0.25893000  0.09473400  1
  Zr  Zr1  1  0.50000000  0.24107000  0.40526600  1
  Zr  Zr2  1  0.50000000  0.75893000  0.40526600  1
  Zr  Zr3  1  0.00000000  0.74107000  0.09473400  1
  Zr  Zr4  1  0.50000000  0.50000000  0.14110100  1
  Zr  Zr5  1  0.00000000  0.00000000  0.35889900  1
  Zr  Zr6  1  0.50000000  0.75893000  0.59473400  1
  Zr  Zr7  1  0.00000000  0.74107000  0.90526600  1
  Zr  Zr8  1  0.00000000  0.25893000  0.90526600  1
  Zr  Zr9  1  0.50000000  0.24107000  0.59473400  1
  Zr  Zr10  1  0.00000000  0.00000000  0.64110100  1
  Zr  Zr11  1  0.50000000  0.50000000  0.85889900  1
  Mn  Mn12  1  0.75000000  0.25000000  0.25000000  1
  Mn  Mn13  1  0.25000000  0.25000000  0.25000000  1
  Mn  Mn14  1  0.75000000  0.75000000  0.25000000  1
  Mn  Mn15  1  0.25000000  0.75000000  0.25000000  1
  Mn  Mn16  1  0.50000000  0.24784600  0.00000000  1
  Mn  Mn17  1  0.50000000  0.75215400  0.00000000  1
  Mn  Mn18  1  0.25000000  0.75000000  0.75000000  1
  Mn  Mn19  1  0.75000000  0.75000000  0.75000000  1
  Mn  Mn20  1  0.25000000  0.25000000  0.75000000  1
  Mn  Mn21  1  0.75000000  0.25000000  0.75000000  1
  Mn  Mn22  1  0.00000000  0.74784600  0.50000000  1
  Mn  Mn23  1  0.00000000  0.25215400  0.50000000  1
  Si  Si24  1  0.75546800  0.00000000  0.00000000  1
  Si  Si25  1  0.24453200  0.00000000  0.00000000  1
  Si  Si26  1  0.24546200  0.50000000  0.00000000  1
  Si  Si27  1  0.75453800  0.50000000  0.00000000  1
  Si  Si28  1  0.00000000  0.00000000  0.20197100  1
  Si  Si29  1  0.50000000  0.50000000  0.29802900  1
  Si  Si30  1  0.50000000  0.00000000  0.28836800  1
  Si  Si31  1  0.00000000  0.50000000  0.21163200  1
  Si  Si32  1  0.00000000  0.35048900  0.36307900  1
  Si  Si33  1  0.50000000  0.14951100  0.13692100  1
  Si  Si34  1  0.50000000  0.85048900  0.13692100  1
  Si  Si35  1  0.00000000  0.64951100  0.36307900  1
  Si  Si36  1  0.25546800  0.50000000  0.50000000  1
  Si  Si37  1  0.74453200  0.50000000  0.50000000  1
  Si  Si38  1  0.74546200  0.00000000  0.50000000  1
  Si  Si39  1  0.25453800  0.00000000  0.50000000  1
  Si  Si40  1  0.50000000  0.50000000  0.70197100  1
  Si  Si41  1  0.00000000  0.00000000  0.79802900  1
  Si  Si42  1  0.00000000  0.50000000  0.78836800  1
  Si  Si43  1  0.50000000  0.00000000  0.71163200  1
  Si  Si44  1  0.50000000  0.85048900  0.86307900  1
  Si  Si45  1  0.00000000  0.64951100  0.63692100  1
  Si  Si46  1  0.00000000  0.35048900  0.63692100  1
  Si  Si47  1  0.50000000  0.14951100  0.86307900  1
