# generated using pymatgen
data_Y4C2Br3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69988341
_cell_length_b   10.75030708
_cell_length_c   20.30860176
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y4C2Br3
_chemical_formula_sum   'Y16 C8 Br12'
_cell_volume   807.77225599
_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
  Y  Y0  1  0.25000000  0.86989993  0.57932042  1.0
  Y  Y1  1  0.75000000  0.13010007  0.42067958  1.0
  Y  Y2  1  0.75000000  0.63010007  0.07932042  1.0
  Y  Y3  1  0.25000000  0.36989993  0.92067958  1.0
  Y  Y4  1  0.25000000  0.87322357  0.74406311  1.0
  Y  Y5  1  0.75000000  0.12677643  0.25593689  1.0
  Y  Y6  1  0.75000000  0.62677643  0.24406311  1.0
  Y  Y7  1  0.25000000  0.37322357  0.75593689  1.0
  Y  Y8  1  0.25000000  0.86163036  0.16879241  1.0
  Y  Y9  1  0.75000000  0.13836964  0.83120759  1.0
  Y  Y10  1  0.75000000  0.63836964  0.66879241  1.0
  Y  Y11  1  0.25000000  0.36163036  0.33120759  1.0
  Y  Y12  1  0.25000000  0.89321272  0.32948326  1.0
  Y  Y13  1  0.75000000  0.10678728  0.67051674  1.0
  Y  Y14  1  0.75000000  0.60678728  0.82948326  1.0
  Y  Y15  1  0.25000000  0.39321272  0.17051674  1.0
  C  C16  1  0.25000000  0.62211930  0.75089438  1.0
  C  C17  1  0.75000000  0.37788070  0.24910562  1.0
  C  C18  1  0.75000000  0.87788070  0.25089438  1.0
  C  C19  1  0.25000000  0.12211930  0.74910562  1.0
  C  C20  1  0.25000000  0.62622744  0.15518669  1.0
  C  C21  1  0.75000000  0.37377256  0.84481331  1.0
  C  C22  1  0.75000000  0.87377256  0.65518669  1.0
  C  C23  1  0.25000000  0.12622744  0.34481331  1.0
  Br  Br24  1  0.25000000  0.61602146  0.55511136  1.0
  Br  Br25  1  0.75000000  0.38397854  0.44488864  1.0
  Br  Br26  1  0.75000000  0.88397854  0.05511136  1.0
  Br  Br27  1  0.25000000  0.11602146  0.94488864  1.0
  Br  Br28  1  0.25000000  0.63170026  0.95432375  1.0
  Br  Br29  1  0.75000000  0.36829974  0.04567625  1.0
  Br  Br30  1  0.75000000  0.86829974  0.45432375  1.0
  Br  Br31  1  0.25000000  0.13170026  0.54567625  1.0
  Br  Br32  1  0.25000000  0.62918553  0.35739841  1.0
  Br  Br33  1  0.75000000  0.37081447  0.64260159  1.0
  Br  Br34  1  0.75000000  0.87081447  0.85739841  1.0
  Br  Br35  1  0.25000000  0.12918553  0.14260159  1.0