# generated using pymatgen
data_Zr4MnS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.05258458
_cell_length_b   7.05258438
_cell_length_c   8.74313002
_cell_angle_alpha   53.52601630
_cell_angle_beta   53.52601419
_cell_angle_gamma   62.23243527
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4MnS8
_chemical_formula_sum   'Zr4 Mn1 S8'
_cell_volume   276.90925502
_cell_formula_units_Z   1
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  0.25689449  0.25689449  0.00391836  1.0
  Zr  Zr1  1  0.74310551  0.74310551  0.99608164  1.0
  Zr  Zr2  1  0.24391560  0.75608440  0.50000000  1.0
  Zr  Zr3  1  0.75608440  0.24391560  0.50000000  1.0
  Mn  Mn4  1  0.00000000  0.00000000  0.00000000  1.0
  S  S5  1  0.29312328  0.29312328  0.67330974  1.0
  S  S6  1  0.79260687  0.79260687  0.66271105  1.0
  S  S7  1  0.28366444  0.79737043  0.16689743  1.0
  S  S8  1  0.79737043  0.28366444  0.16689743  1.0
  S  S9  1  0.20262957  0.71633556  0.83310257  1.0
  S  S10  1  0.71633556  0.20262957  0.83310257  1.0
  S  S11  1  0.20739313  0.20739313  0.33728895  1.0
  S  S12  1  0.70687672  0.70687672  0.32669026  1.0