# generated using pymatgen
data_Sc12CoTc2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90452893
_cell_length_b   8.59319398
_cell_length_c   13.13465663
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc12CoTc2Ni
_chemical_formula_sum   'Sc24 Co2 Tc4 Ni2'
_cell_volume   666.43622291
_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
  Sc  Sc0  1  0.52544661  0.75000000  0.35169110  1.0
  Sc  Sc1  1  0.02544661  0.25000000  0.14830890  1.0
  Sc  Sc2  1  0.47229912  0.25000000  0.64951638  1.0
  Sc  Sc3  1  0.97229912  0.75000000  0.85048362  1.0
  Sc  Sc4  1  0.78748605  0.75000000  0.11465280  1.0
  Sc  Sc5  1  0.28748605  0.25000000  0.38534720  1.0
  Sc  Sc6  1  0.21698317  0.25000000  0.88669642  1.0
  Sc  Sc7  1  0.71698317  0.75000000  0.61330358  1.0
  Sc  Sc8  1  0.41022070  0.93444263  0.78475323  1.0
  Sc  Sc9  1  0.91022070  0.06555737  0.71524677  1.0
  Sc  Sc10  1  0.59131233  0.43547189  0.21490742  1.0
  Sc  Sc11  1  0.09131233  0.56452811  0.28509258  1.0
  Sc  Sc12  1  0.59131233  0.06452811  0.21490742  1.0
  Sc  Sc13  1  0.09131233  0.93547189  0.28509258  1.0
  Sc  Sc14  1  0.41022070  0.56555737  0.78475323  1.0
  Sc  Sc15  1  0.91022070  0.43444263  0.71524677  1.0
  Sc  Sc16  1  0.24566219  0.93930416  0.53729694  1.0
  Sc  Sc17  1  0.74566219  0.06069584  0.96270306  1.0
  Sc  Sc18  1  0.75297368  0.44206718  0.46437332  1.0
  Sc  Sc19  1  0.25297368  0.55793282  0.03562668  1.0
  Sc  Sc20  1  0.75297368  0.05793282  0.46437332  1.0
  Sc  Sc21  1  0.25297368  0.94206718  0.03562668  1.0
  Sc  Sc22  1  0.24566219  0.56069584  0.53729694  1.0
  Sc  Sc23  1  0.74566219  0.43930416  0.96270306  1.0
  Co  Co24  1  0.63224611  0.25000000  0.82059524  1.0
  Co  Co25  1  0.13224611  0.75000000  0.67940476  1.0
  Tc  Tc26  1  0.93035873  0.75000000  0.43651601  1.0
  Tc  Tc27  1  0.43035873  0.25000000  0.06348399  1.0
  Tc  Tc28  1  0.06929677  0.25000000  0.55951433  1.0
  Tc  Tc29  1  0.56929677  0.75000000  0.94048567  1.0
  Ni  Ni30  1  0.36554665  0.75000000  0.17548632  1.0
  Ni  Ni31  1  0.86554665  0.25000000  0.32451368  1.0