# generated using pymatgen
data_Cr3S4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94757195
_cell_length_b   3.44326928
_cell_length_c   11.09505703
_cell_angle_alpha   90.00000000
_cell_angle_beta   91.23413310
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3S4
_chemical_formula_sum   'Cr6 S8'
_cell_volume   227.16398382
_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  0.74735700  0.75000000  0.75184900  1
  Cr  Cr1  1  0.25264300  0.25000000  0.24815100  1
  Cr  Cr2  1  0.21795000  0.25000000  0.51328300  1
  Cr  Cr3  1  0.73538300  0.75000000  0.01028700  1
  Cr  Cr4  1  0.78205000  0.75000000  0.48671700  1
  Cr  Cr5  1  0.26461700  0.25000000  0.98971300  1
  S  S6  1  0.08142300  0.75000000  0.63370600  1
  S  S7  1  0.58157300  0.25000000  0.12666100  1
  S  S8  1  0.59271600  0.25000000  0.61448300  1
  S  S9  1  0.09078200  0.75000000  0.11589700  1
  S  S10  1  0.40728400  0.75000000  0.38551700  1
  S  S11  1  0.90921800  0.25000000  0.88410300  1
  S  S12  1  0.91857700  0.25000000  0.36629400  1
  S  S13  1  0.41842700  0.75000000  0.87333900  1
