# generated using pymatgen
data_ScCrGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.17332400
_cell_length_b   9.42169500
_cell_length_c   10.12688500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCrGe2
_chemical_formula_sum   'Sc12 Cr12 Ge24'
_cell_volume   779.83663675
_cell_formula_units_Z   12
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  0.74429900  0.83006000  0.04612900  1.0
  Sc  Sc1  1  0.74429900  0.16994000  0.95387100  1.0
  Sc  Sc2  1  0.25570100  0.66994000  0.54612900  1.0
  Sc  Sc3  1  0.25570100  0.33006000  0.45387100  1.0
  Sc  Sc4  1  0.25570100  0.16994000  0.95387100  1.0
  Sc  Sc5  1  0.25570100  0.83006000  0.04612900  1.0
  Sc  Sc6  1  0.74429900  0.33006000  0.45387100  1.0
  Sc  Sc7  1  0.74429900  0.66994000  0.54612900  1.0
  Sc  Sc8  1  0.50000000  0.83467400  0.32011900  1.0
  Sc  Sc9  1  0.50000000  0.16532600  0.67988100  1.0
  Sc  Sc10  1  0.50000000  0.66532600  0.82011900  1.0
  Sc  Sc11  1  0.50000000  0.33467400  0.17988100  1.0
  Cr  Cr12  1  0.74944300  0.58134300  0.24511900  1.0
  Cr  Cr13  1  0.74944300  0.41865700  0.75488100  1.0
  Cr  Cr14  1  0.25055700  0.91865700  0.74511900  1.0
  Cr  Cr15  1  0.25055700  0.08134300  0.25488100  1.0
  Cr  Cr16  1  0.25055700  0.41865700  0.75488100  1.0
  Cr  Cr17  1  0.25055700  0.58134300  0.24511900  1.0
  Cr  Cr18  1  0.74944300  0.08134300  0.25488100  1.0
  Cr  Cr19  1  0.74944300  0.91865700  0.74511900  1.0
  Cr  Cr20  1  0.74493600  0.00000000  0.50000000  1.0
  Cr  Cr21  1  0.25506400  0.50000000  0.00000000  1.0
  Cr  Cr22  1  0.25506400  0.00000000  0.50000000  1.0
  Cr  Cr23  1  0.74493600  0.50000000  0.00000000  1.0
  Ge  Ge24  1  0.84025900  0.83099200  0.31765200  1.0
  Ge  Ge25  1  0.84025900  0.16900800  0.68234800  1.0
  Ge  Ge26  1  0.15974100  0.66900800  0.81765200  1.0
  Ge  Ge27  1  0.15974100  0.33099200  0.18234800  1.0
  Ge  Ge28  1  0.15974100  0.16900800  0.68234800  1.0
  Ge  Ge29  1  0.15974100  0.83099200  0.31765200  1.0
  Ge  Ge30  1  0.84025900  0.33099200  0.18234800  1.0
  Ge  Ge31  1  0.84025900  0.66900800  0.81765200  1.0
  Ge  Ge32  1  0.50000000  0.54061500  0.37958800  1.0
  Ge  Ge33  1  0.50000000  0.45938500  0.62041200  1.0
  Ge  Ge34  1  0.50000000  0.95938500  0.87958800  1.0
  Ge  Ge35  1  0.50000000  0.04061500  0.12041200  1.0
  Ge  Ge36  1  0.00000000  0.54199100  0.37745200  1.0
  Ge  Ge37  1  0.00000000  0.45800900  0.62254800  1.0
  Ge  Ge38  1  0.00000000  0.95800900  0.87745200  1.0
  Ge  Ge39  1  0.00000000  0.04199100  0.12254800  1.0
  Ge  Ge40  1  0.50000000  0.63294300  0.09971700  1.0
  Ge  Ge41  1  0.50000000  0.36705700  0.90028300  1.0
  Ge  Ge42  1  0.50000000  0.86705700  0.59971700  1.0
  Ge  Ge43  1  0.50000000  0.13294300  0.40028300  1.0
  Ge  Ge44  1  0.00000000  0.62622000  0.09287400  1.0
  Ge  Ge45  1  0.00000000  0.37378000  0.90712600  1.0
  Ge  Ge46  1  0.00000000  0.87378000  0.59287400  1.0
  Ge  Ge47  1  0.00000000  0.12622000  0.40712600  1.0