# generated using pymatgen
data_Ca7(B7Rh10)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.87641008
_cell_length_b   20.49006411
_cell_length_c   5.62374226
_cell_angle_alpha   86.10752844
_cell_angle_beta   78.30190602
_cell_angle_gamma   15.59056554
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7(B7Rh10)2
_chemical_formula_sum   'Ca7 B14 Rh20'
_cell_volume   553.96732753
_cell_formula_units_Z   1
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
  Ca  Ca0  1  0.64653500  0.64653500  0.35346500  1.0
  Ca  Ca1  1  0.27780100  0.27780100  0.72219900  1.0
  Ca  Ca2  1  0.72219900  0.72219900  0.27780100  1.0
  Ca  Ca3  1  0.50000000  0.50000000  0.50000000  1.0
  Ca  Ca4  1  0.35346500  0.35346500  0.64653500  1.0
  Ca  Ca5  1  0.57293900  0.57293900  0.42706100  1.0
  Ca  Ca6  1  0.42706100  0.42706100  0.57293900  1.0
  B  B7  1  0.76135800  0.09424700  0.90575300  1.0
  B  B8  1  0.02232600  0.68912400  0.31087600  1.0
  B  B9  1  0.31087600  0.97767400  0.02232600  1.0
  B  B10  1  0.97767400  0.31087600  0.68912400  1.0
  B  B11  1  0.37781500  0.05515800  0.94484200  1.0
  B  B12  1  0.23864200  0.90575300  0.09424700  1.0
  B  B13  1  0.16632700  0.83367300  0.16632700  1.0
  B  B14  1  0.05515800  0.37781500  0.62218500  1.0
  B  B15  1  0.90575300  0.23864200  0.76135800  1.0
  B  B16  1  0.09424700  0.76135800  0.23864200  1.0
  B  B17  1  0.83367300  0.16632700  0.83367300  1.0
  B  B18  1  0.94484200  0.62218500  0.37781500  1.0
  B  B19  1  0.68912400  0.02232600  0.97767400  1.0
  B  B20  1  0.62218500  0.94484200  0.05515800  1.0
  Rh  Rh21  1  0.31973100  0.31973100  0.18026900  1.0
  Rh  Rh22  1  0.10803300  0.10803300  0.89196700  1.0
  Rh  Rh23  1  0.96396900  0.96396900  0.53603100  1.0
  Rh  Rh24  1  0.81928600  0.81928600  0.18071400  1.0
  Rh  Rh25  1  0.60829200  0.60829200  0.89170800  1.0
  Rh  Rh26  1  0.89196700  0.89196700  0.10803300  1.0
  Rh  Rh27  1  0.03597600  0.03597600  0.96402400  1.0
  Rh  Rh28  1  0.10829200  0.10829200  0.39170800  1.0
  Rh  Rh29  1  0.18026900  0.18026900  0.31973100  1.0
  Rh  Rh30  1  0.53603100  0.53603100  0.96396900  1.0
  Rh  Rh31  1  0.03603100  0.03603100  0.46396900  1.0
  Rh  Rh32  1  0.68026900  0.68026900  0.81973100  1.0
  Rh  Rh33  1  0.39170800  0.39170800  0.10829200  1.0
  Rh  Rh34  1  0.25000000  0.25000000  0.25000000  1.0
  Rh  Rh35  1  0.46396900  0.46396900  0.03603100  1.0
  Rh  Rh36  1  0.18071400  0.18071400  0.81928600  1.0
  Rh  Rh37  1  0.96402400  0.96402400  0.03597600  1.0
  Rh  Rh38  1  0.89170800  0.89170800  0.60829200  1.0
  Rh  Rh39  1  0.75000000  0.75000000  0.75000000  1.0
  Rh  Rh40  1  0.81973100  0.81973100  0.68026900  1.0