# generated using pymatgen
data_Cu3TeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.26623563
_cell_length_b   8.26712732
_cell_length_c   8.26713805
_cell_angle_alpha   109.46853187
_cell_angle_beta   109.47524469
_cell_angle_gamma   109.47120572
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3TeO6
_chemical_formula_sum   'Cu12 Te4 O24'
_cell_volume   434.89921845
_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
  Cu  Cu0  1  0.71826694  0.46825612  0.24989165  1.0
  Cu  Cu1  1  0.74999366  0.78164265  0.03166171  1.0
  Cu  Cu2  1  0.03167468  0.74999214  0.78167397  1.0
  Cu  Cu3  1  0.24995405  0.71830525  0.46831666  1.0
  Cu  Cu4  1  0.46831553  0.24997368  0.71829861  1.0
  Cu  Cu5  1  0.78170001  0.03164164  0.74997524  1.0
  Cu  Cu6  1  0.28173616  0.53174163  0.75010631  1.0
  Cu  Cu7  1  0.25000750  0.21835675  0.96834066  1.0
  Cu  Cu8  1  0.96831913  0.25000532  0.21832908  1.0
  Cu  Cu9  1  0.75004330  0.28169689  0.53168408  1.0
  Cu  Cu10  1  0.53169036  0.75003375  0.28170213  1.0
  Cu  Cu11  1  0.21829893  0.96835359  0.25002087  1.0
  Te  Te12  1  0.50000242  0.00000961  0.00000541  1.0
  Te  Te13  1  -0.00000175  0.00000349  0.50000914  1.0
  Te  Te14  1  0.00000268  0.50000595  0.00000681  1.0
  Te  Te15  1  0.49999843  0.50000547  0.50000508  1.0
  O  O16  1  0.53124403  0.80762038  0.07186241  1.0
  O  O17  1  0.26423785  0.69231222  0.22358716  1.0
  O  O18  1  0.96875002  0.04061831  0.27638089  1.0
  O  O19  1  0.45933789  0.42812824  0.23572569  1.0
  O  O20  1  0.42809600  0.23573919  0.45931769  1.0
  O  O21  1  0.07189317  0.53120608  0.80762588  1.0
  O  O22  1  0.69236966  0.22354509  0.26419562  1.0
  O  O23  1  0.27645374  0.96870203  0.04069478  1.0
  O  O24  1  0.80760949  0.07182294  0.53117141  1.0
  O  O25  1  0.22353537  0.26422726  0.69223770  1.0
  O  O26  1  0.04067253  0.27639313  0.96879796  1.0
  O  O27  1  0.23574787  0.45935697  0.42806962  1.0
  O  O28  1  0.46875707  0.19237629  0.92813718  1.0
  O  O29  1  0.73576049  0.30768618  0.77640876  1.0
  O  O30  1  0.03124865  0.95938198  0.72361479  1.0
  O  O31  1  0.54065890  0.57186694  0.76426651  1.0
  O  O32  1  0.76425328  0.54064302  0.57193219  1.0
  O  O33  1  0.95933381  0.72360193  0.03120111  1.0
  O  O34  1  0.77646186  0.73577154  0.30776321  1.0
  O  O35  1  0.19239306  0.92817516  0.46882915  1.0
  O  O36  1  0.72354933  0.03129952  0.95930731  1.0
  O  O37  1  0.30762663  0.77645062  0.73579574  1.0
  O  O38  1  0.92810937  0.46879522  0.19236895  1.0
  O  O39  1  0.57189791  0.76425581  0.54068089  1.0