# generated using pymatgen
data_Cu2Mo3Se4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85871300
_cell_length_b   6.91136158
_cell_length_c   8.01230862
_cell_angle_alpha   109.25168716
_cell_angle_beta   106.81051060
_cell_angle_gamma   84.61087153
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2Mo3Se4
_chemical_formula_sum   'Cu4 Mo6 Se8'
_cell_volume   343.24536997
_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
  Cu  Cu0  1  0.77733200  0.96322800  0.06426300  1.0
  Cu  Cu1  1  0.22266800  0.03677200  0.93573700  1.0
  Cu  Cu2  1  0.46363800  0.71236300  0.91377400  1.0
  Cu  Cu3  1  0.53636200  0.28763700  0.08622600  1.0
  Mo  Mo4  1  0.42048300  0.27949900  0.54628300  1.0
  Mo  Mo5  1  0.49433500  0.98815800  0.25821400  1.0
  Mo  Mo6  1  0.50566500  0.01184200  0.74178600  1.0
  Mo  Mo7  1  0.22053600  0.92036800  0.41309300  1.0
  Mo  Mo8  1  0.57951700  0.72050100  0.45371700  1.0
  Mo  Mo9  1  0.77946400  0.07963200  0.58690700  1.0
  Se  Se10  1  0.16217600  0.21605400  0.70357300  1.0
  Se  Se11  1  0.30992300  0.63060700  0.13343000  1.0
  Se  Se12  1  0.70553200  0.33430900  0.40626900  1.0
  Se  Se13  1  0.69007700  0.36939300  0.86657000  1.0
  Se  Se14  1  0.13719100  0.17771700  0.22923600  1.0
  Se  Se15  1  0.83782400  0.78394600  0.29642700  1.0
  Se  Se16  1  0.86280900  0.82228300  0.77076400  1.0
  Se  Se17  1  0.29446800  0.66569100  0.59373100  1.0