# generated using pymatgen
data_Tm3Zr(Ta3Ge4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89484658
_cell_length_b   7.05113965
_cell_length_c   13.33280688
_cell_angle_alpha   89.83252235
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Zr(Ta3Ge4)2
_chemical_formula_sum   'Tm6 Zr2 Ta12 Ge16'
_cell_volume   648.19198501
_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
  Tm  Tm0  1  0.50539097  0.32495417  0.09350125  1.0
  Tm  Tm1  1  0.00539097  0.17504583  0.40649875  1.0
  Tm  Tm2  1  0.50634958  0.32678308  0.40667231  1.0
  Tm  Tm3  1  0.00634958  0.17321692  0.09332769  1.0
  Tm  Tm4  1  0.49240357  0.67525304  0.90596303  1.0
  Tm  Tm5  1  0.99240357  0.82474696  0.59403697  1.0
  Zr  Zr6  1  0.49016703  0.67790983  0.59641698  1.0
  Zr  Zr7  1  0.99016703  0.82209017  0.90358302  1.0
  Ta  Ta8  1  0.65914644  0.16920073  0.62568203  1.0
  Ta  Ta9  1  0.15914644  0.33079927  0.87431797  1.0
  Ta  Ta10  1  0.34250176  0.83003433  0.12619800  1.0
  Ta  Ta11  1  0.84250176  0.66996567  0.37380200  1.0
  Ta  Ta12  1  0.34415126  0.82783330  0.37568457  1.0
  Ta  Ta13  1  0.84415126  0.67216670  0.12431543  1.0
  Ta  Ta14  1  0.66025558  0.16712066  0.87329392  1.0
  Ta  Ta15  1  0.16025558  0.33287934  0.62670608  1.0
  Ta  Ta16  1  0.83433501  0.48888094  0.75052314  1.0
  Ta  Ta17  1  0.33433501  0.01111906  0.74947686  1.0
  Ta  Ta18  1  0.16670776  0.51350675  0.25011148  1.0
  Ta  Ta19  1  0.66670776  0.98649325  0.24988852  1.0
  Ge  Ge20  1  0.67803948  0.95955341  0.46024360  1.0
  Ge  Ge21  1  0.17803948  0.54044659  0.03975640  1.0
  Ge  Ge22  1  0.31532890  0.03560254  0.95846174  1.0
  Ge  Ge23  1  0.81532890  0.46439746  0.54153826  1.0
  Ge  Ge24  1  0.32224800  0.03808188  0.54159825  1.0
  Ge  Ge25  1  0.82224800  0.46191812  0.95840175  1.0
  Ge  Ge26  1  0.67977426  0.96151596  0.03950057  1.0
  Ge  Ge27  1  0.17977426  0.53848404  0.46049943  1.0
  Ge  Ge28  1  0.46007665  0.38402224  0.75001099  1.0
  Ge  Ge29  1  0.96007665  0.11597776  0.74998901  1.0
  Ge  Ge30  1  0.54270935  0.61756828  0.24943535  1.0
  Ge  Ge31  1  0.04270935  0.88243172  0.25056465  1.0
  Ge  Ge32  1  0.69322417  0.85576359  0.74937714  1.0
  Ge  Ge33  1  0.19322417  0.64423641  0.75062286  1.0
  Ge  Ge34  1  0.30719024  0.14238877  0.25055287  1.0
  Ge  Ge35  1  0.80719024  0.35761123  0.24944713  1.0