# generated using pymatgen
data_Cr(MoS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84879029
_cell_length_b   6.84879029
_cell_length_c   12.99364439
_cell_angle_alpha   68.82013888
_cell_angle_beta   68.82013888
_cell_angle_gamma   57.55802012
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr(MoS2)2
_chemical_formula_sum   'Cr4 Mo8 S16'
_cell_volume   468.62782851
_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
  Cr  Cr0  1  0.86446000  0.61715000  0.25195200  1.0
  Cr  Cr1  1  0.61715000  0.86446000  0.75195200  1.0
  Cr  Cr2  1  0.13554000  0.38285000  0.74804800  1.0
  Cr  Cr3  1  0.38285000  0.13554000  0.24804800  1.0
  Mo  Mo4  1  0.20079100  0.99595300  0.50614500  1.0
  Mo  Mo5  1  0.99595300  0.20079100  0.00614500  1.0
  Mo  Mo6  1  0.79920900  0.00404700  0.49385500  1.0
  Mo  Mo7  1  0.00404700  0.79920900  0.99385500  1.0
  Mo  Mo8  1  0.26344200  0.55713700  0.49211700  1.0
  Mo  Mo9  1  0.55713700  0.26344200  0.99211700  1.0
  Mo  Mo10  1  0.73655800  0.44286300  0.50788300  1.0
  Mo  Mo11  1  0.44286300  0.73655800  0.00788300  1.0
  S  S12  1  0.15727900  0.91463300  0.35258800  1.0
  S  S13  1  0.91463300  0.15727900  0.85258800  1.0
  S  S14  1  0.84272100  0.08536700  0.64741200  1.0
  S  S15  1  0.08536700  0.84272100  0.14741200  1.0
  S  S16  1  0.37025500  0.12625900  0.60516500  1.0
  S  S17  1  0.12625900  0.37025500  0.10516500  1.0
  S  S18  1  0.62974500  0.87374100  0.39483500  1.0
  S  S19  1  0.87374100  0.62974500  0.89483500  1.0
  S  S20  1  0.87004200  0.60254800  0.61277200  1.0
  S  S21  1  0.60254800  0.87004200  0.11277200  1.0
  S  S22  1  0.12995800  0.39745200  0.38722800  1.0
  S  S23  1  0.39745200  0.12995800  0.88722800  1.0
  S  S24  1  0.64729400  0.38427500  0.36455600  1.0
  S  S25  1  0.38427500  0.64729400  0.86455600  1.0
  S  S26  1  0.35270600  0.61572500  0.63544400  1.0
  S  S27  1  0.61572500  0.35270600  0.13544400  1.0