# generated using pymatgen
data_GaCu5Se6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73623191
_cell_length_b   6.73623183
_cell_length_c   12.26450303
_cell_angle_alpha   79.53441737
_cell_angle_beta   100.46558249
_cell_angle_gamma   70.09257468
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaCu5Se6
_chemical_formula_sum   'Ga2 Cu10 Se12'
_cell_volume   496.39941495
_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
  Ga  Ga0  1  0.41746511  0.08482813  0.83246007  1.0
  Ga  Ga1  1  0.08482813  0.41746511  0.16753993  1.0
  Cu  Cu2  1  0.74677050  0.74677050  0.50000000  1.0
  Cu  Cu3  1  0.83732722  0.16166112  0.66451253  1.0
  Cu  Cu4  1  0.50250654  0.50250654  0.00000000  1.0
  Cu  Cu5  1  0.16166112  0.83732722  0.33548747  1.0
  Cu  Cu6  1  0.24504511  0.24504511  0.50000000  1.0
  Cu  Cu7  1  0.91949576  0.58759766  0.83070953  1.0
  Cu  Cu8  1  0.58759766  0.91949576  0.16929047  1.0
  Cu  Cu9  1  0.32754866  0.67156083  0.66442790  1.0
  Cu  Cu10  1  0.00243110  0.00243110  0.00000000  1.0
  Cu  Cu11  1  0.67156083  0.32754866  0.33557210  1.0
  Se  Se12  1  0.12550448  0.62894344  0.99660182  1.0
  Se  Se13  1  0.79108515  0.95546808  0.33678288  1.0
  Se  Se14  1  0.45829973  0.29580146  0.66221348  1.0
  Se  Se15  1  0.62894344  0.12550448  0.00339818  1.0
  Se  Se16  1  0.29580146  0.45829973  0.33778652  1.0
  Se  Se17  1  0.95546808  0.79108515  0.66321712  1.0
  Se  Se18  1  0.03492905  0.21152406  0.83147028  1.0
  Se  Se19  1  0.70330850  0.54353920  0.16857843  1.0
  Se  Se20  1  0.37332196  0.87403615  0.49989214  1.0
  Se  Se21  1  0.87403615  0.37332196  0.50010786  1.0
  Se  Se22  1  0.54353920  0.70330850  0.83142157  1.0
  Se  Se23  1  0.21152406  0.03492905  0.16852972  1.0