# generated using pymatgen
data_V3S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53016911
_cell_length_b   7.02894877
_cell_length_c   7.02894849
_cell_angle_alpha   84.03878056
_cell_angle_beta   71.20024713
_cell_angle_gamma   71.20025806
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V3S
_chemical_formula_sum   'V12 S4'
_cell_volume   200.57400927
_cell_formula_units_Z   4
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
  V  V0  1  0.45911337  0.00000950  0.59982393  1.0
  V  V1  1  0.94105207  0.59975910  0.00000440  1.0
  V  V2  1  0.54088663  0.40017607  0.99999050  1.0
  V  V3  1  0.05894793  -0.00000440  0.40024090  1.0
  V  V4  1  0.35747505  0.64254704  0.64253436  1.0
  V  V5  1  -0.00000000  0.64255846  0.35744154  1.0
  V  V6  1  0.00000000  0.35748703  0.64251297  1.0
  V  V7  1  0.64252495  0.35746564  0.35745296  1.0
  V  V8  1  0.67070286  0.00002285  0.18253928  1.0
  V  V9  1  0.14683853  0.18246991  0.99998942  1.0
  V  V10  1  0.32929714  0.81746072  0.99997715  1.0
  V  V11  1  0.85316147  0.00001058  0.81753009  1.0
  S  S12  1  0.21163928  0.28834965  0.28836030  1.0
  S  S13  1  0.50000000  0.28837494  0.71162506  1.0
  S  S14  1  0.50000000  0.71167420  0.28832580  1.0
  S  S15  1  0.78835972  0.71163970  0.71165035  1.0