# generated using pymatgen
data_Cr5NiAs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64821502
_cell_length_b   11.13760418
_cell_length_c   6.28199996
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr5NiAs3
_chemical_formula_sum   'Cr10 Ni2 As6'
_cell_volume   255.25257722
_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
  Cr  Cr0  1  0.59829200  0.00000000  0.50000000  1
  Cr  Cr1  1  0.19843600  0.20692200  0.50000000  1
  Cr  Cr2  1  0.69843600  0.29307800  0.50000000  1
  Cr  Cr3  1  0.37386300  0.37649700  0.00000000  1
  Cr  Cr4  1  0.87386300  0.12350300  0.00000000  1
  Cr  Cr5  1  0.09829200  0.50000000  0.50000000  1
  Cr  Cr6  1  0.69843600  0.70692200  0.50000000  1
  Cr  Cr7  1  0.19843600  0.79307800  0.50000000  1
  Cr  Cr8  1  0.87386300  0.87649700  0.00000000  1
  Cr  Cr9  1  0.37386300  0.62350300  0.00000000  1
  Ni  Ni10  1  0.25479300  0.00000000  0.00000000  1
  Ni  Ni11  1  0.75479300  0.50000000  0.00000000  1
  As  As12  1  0.99430400  0.33444400  0.00000000  1
  As  As13  1  0.49430400  0.16555600  0.00000000  1
  As  As14  1  0.01360900  0.00000000  0.50000000  1
  As  As15  1  0.49430400  0.83444400  0.00000000  1
  As  As16  1  0.99430400  0.66555600  0.00000000  1
  As  As17  1  0.51360900  0.50000000  0.50000000  1
