# generated using pymatgen
data_Ni4As3S5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.08137038
_cell_length_b   8.08137038
_cell_length_c   9.72063073
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni4As3S5
_chemical_formula_sum   'Ni12 As9 S15'
_cell_volume   549.78780205
_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
  Ni  Ni0  1  0.00000000  0.00000000  0.99350300  1
  Ni  Ni1  1  0.99892900  0.49307800  0.00205200  1
  Ni  Ni2  1  0.84025500  0.17251800  0.66871900  1
  Ni  Ni3  1  0.82748200  0.66773700  0.66871900  1
  Ni  Ni4  1  0.66666700  0.33333300  0.32683700  1
  Ni  Ni5  1  0.66559600  0.82641100  0.33538500  1
  Ni  Ni6  1  0.50692200  0.50585100  0.00205200  1
  Ni  Ni7  1  0.49414900  0.00107100  0.00205200  1
  Ni  Ni8  1  0.33333300  0.66666700  0.66017000  1
  Ni  Ni9  1  0.33226300  0.15974500  0.66871900  1
  Ni  Ni10  1  0.17358900  0.83918500  0.33538500  1
  Ni  Ni11  1  0.16081500  0.33440400  0.33538500  1
  As  As12  1  0.25293400  0.24434200  0.12696600  1
  As  As13  1  0.08899100  0.67525900  0.79363300  1
  As  As14  1  0.32474100  0.41373200  0.79363300  1
  As  As15  1  0.91960100  0.57767500  0.46029900  1
  As  As16  1  0.75565800  0.00859200  0.12696600  1
  As  As17  1  0.99140800  0.74706600  0.12696600  1
  As  As18  1  0.58626800  0.91100900  0.79363300  1
  As  As19  1  0.42232500  0.34192600  0.46029900  1
  As  As20  1  0.65807400  0.08039900  0.46029900  1
  S  S21  1  0.33333300  0.66666700  0.06162800  1
  S  S22  1  0.07827700  0.42401200  0.53851000  1
  S  S23  1  0.24265500  0.98759900  0.87184300  1
  S  S24  1  0.01240100  0.25505600  0.87184300  1
  S  S25  1  0.00000000  0.00000000  0.60895200  1
  S  S26  1  0.00000000  0.00000000  0.39496200  1
  S  S27  1  0.74494400  0.75734500  0.87184300  1
  S  S28  1  0.90932200  0.32093200  0.20517600  1
  S  S29  1  0.67906800  0.58838900  0.20517600  1
  S  S30  1  0.66666700  0.33333300  0.94228500  1
  S  S31  1  0.66666700  0.33333300  0.72829500  1
  S  S32  1  0.41161100  0.09067800  0.20517600  1
  S  S33  1  0.57598800  0.65426600  0.53851000  1
  S  S34  1  0.34573400  0.92172300  0.53851000  1
  S  S35  1  0.33333300  0.66666700  0.27561800  1
