# generated using pymatgen
data_Na4Ni2C4SO16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.93315164
_cell_length_b   9.90239257
_cell_length_c   9.81714355
_cell_angle_alpha   60.49118440
_cell_angle_beta   60.17920290
_cell_angle_gamma   59.32961270
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na4Ni2C4SO16
_chemical_formula_sum   'Na8 Ni4 C8 S2 O32'
_cell_volume   682.65642546
_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
  Na  Na0  1  0.28884500  0.71115500  0.71115500  1.0
  Na  Na1  1  0.71003300  0.28996700  0.71003300  1.0
  Na  Na2  1  0.96003300  0.53996700  0.96003300  1.0
  Na  Na3  1  0.53884500  0.96115500  0.96115500  1.0
  Na  Na4  1  0.71115500  0.28884500  0.28884500  1.0
  Na  Na5  1  0.28996700  0.71003300  0.28996700  1.0
  Na  Na6  1  0.53996700  0.96003300  0.53996700  1.0
  Na  Na7  1  0.96115500  0.53884500  0.53884500  1.0
  Ni  Ni8  1  0.12500000  0.12500000  0.62500000  1.0
  Ni  Ni9  1  0.12500000  0.12500000  0.12500000  1.0
  Ni  Ni10  1  0.12500000  0.62500000  0.12500000  1.0
  Ni  Ni11  1  0.62500000  0.12500000  0.12500000  1.0
  C  C12  1  0.33470400  0.33762800  0.98203700  1.0
  C  C13  1  0.91237200  0.91529600  0.90436900  1.0
  C  C14  1  0.34563100  0.98203700  0.33762800  1.0
  C  C15  1  0.98203700  0.34563100  0.33470400  1.0
  C  C16  1  0.26796300  0.90436900  0.91529600  1.0
  C  C17  1  0.90436900  0.26796300  0.91237200  1.0
  C  C18  1  0.33762800  0.33470400  0.34563100  1.0
  C  C19  1  0.91529600  0.91237200  0.26796300  1.0
  S  S20  1  0.75000000  0.75000000  0.75000000  1.0
  S  S21  1  0.50000000  0.50000000  0.50000000  1.0
  O  O22  1  0.31302200  0.48106400  0.97493300  1.0
  O  O23  1  0.93507000  0.68497600  0.68903100  1.0
  O  O24  1  0.21452000  0.31494000  0.98999400  1.0
  O  O25  1  0.93506000  0.03548000  0.76945300  1.0
  O  O26  1  0.48054700  0.98999400  0.31494000  1.0
  O  O27  1  0.02896700  0.77128200  0.92455500  1.0
  O  O28  1  0.69092300  0.68903100  0.68497600  1.0
  O  O29  1  0.68497600  0.93507000  0.69092300  1.0
  O  O30  1  0.92455500  0.27519700  0.02896700  1.0
  O  O31  1  0.98999400  0.48054700  0.21452000  1.0
  O  O32  1  0.76893600  0.93697800  0.01901900  1.0
  O  O33  1  0.68903100  0.69092300  0.93507000  1.0
  O  O34  1  0.23098100  0.97493300  0.48106400  1.0
  O  O35  1  0.97493300  0.23098100  0.31302200  1.0
  O  O36  1  0.47871800  0.22103300  0.97480300  1.0
  O  O37  1  0.27519700  0.92455500  0.77128200  1.0
  O  O38  1  0.97480300  0.32544500  0.47871800  1.0
  O  O39  1  0.77128200  0.02896700  0.27519700  1.0
  O  O40  1  0.27506700  0.01901900  0.93697800  1.0
  O  O41  1  0.01901900  0.27506700  0.76893600  1.0
  O  O42  1  0.56096900  0.55907700  0.31493000  1.0
  O  O43  1  0.48106400  0.31302200  0.23098100  1.0
  O  O44  1  0.26000600  0.76945300  0.03548000  1.0
  O  O45  1  0.32544500  0.97480300  0.22103300  1.0
  O  O46  1  0.56502400  0.31493000  0.55907700  1.0
  O  O47  1  0.55907700  0.56096900  0.56502400  1.0
  O  O48  1  0.22103300  0.47871800  0.32544500  1.0
  O  O49  1  0.76945300  0.26000600  0.93506000  1.0
  O  O50  1  0.31494000  0.21452000  0.48054700  1.0
  O  O51  1  0.03548000  0.93506000  0.26000600  1.0
  O  O52  1  0.31493000  0.56502400  0.56096900  1.0
  O  O53  1  0.93697800  0.76893600  0.27506700  1.0