# generated using pymatgen
data_BaCrF7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.00099500
_cell_length_b   5.52278400
_cell_length_c   9.97832273
_cell_angle_alpha   85.52091449
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCrF7
_chemical_formula_sum   'Ba4 Cr4 F28'
_cell_volume   549.45282281
_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
  Ba  Ba0  1  0.29214400  0.74303700  0.49293500  1.0
  Ba  Ba1  1  0.79214400  0.25696300  0.00706500  1.0
  Ba  Ba2  1  0.70785600  0.25696300  0.50706500  1.0
  Ba  Ba3  1  0.20785600  0.74303700  0.99293500  1.0
  Cr  Cr4  1  0.61322200  0.81339800  0.81165300  1.0
  Cr  Cr5  1  0.38677800  0.18660200  0.18834700  1.0
  Cr  Cr6  1  0.88677800  0.81339800  0.31165300  1.0
  Cr  Cr7  1  0.11322200  0.18660200  0.68834700  1.0
  F  F8  1  0.44966500  0.90884700  0.12867100  1.0
  F  F9  1  0.03981600  0.65918400  0.36313000  1.0
  F  F10  1  0.69080300  0.53601900  0.75946700  1.0
  F  F11  1  0.30919700  0.46398100  0.24053300  1.0
  F  F12  1  0.45308500  0.10640400  0.35950900  1.0
  F  F13  1  0.80699500  0.74434400  0.47811100  1.0
  F  F14  1  0.76418700  0.99293100  0.75945700  1.0
  F  F15  1  0.95308500  0.89359600  0.14049100  1.0
  F  F16  1  0.46018400  0.65918400  0.86313000  1.0
  F  F17  1  0.19080300  0.46398100  0.74053300  1.0
  F  F18  1  0.05033500  0.90884700  0.62867100  1.0
  F  F19  1  0.55033500  0.09115300  0.87132900  1.0
  F  F20  1  0.26418700  0.00706900  0.74054300  1.0
  F  F21  1  0.96806800  0.59282100  0.91540900  1.0
  F  F22  1  0.54691500  0.89359600  0.64049100  1.0
  F  F23  1  0.04691500  0.10640400  0.85950900  1.0
  F  F24  1  0.23581300  0.00706900  0.24054300  1.0
  F  F25  1  0.94966500  0.09115300  0.37132900  1.0
  F  F26  1  0.46806800  0.40717900  0.58459100  1.0
  F  F27  1  0.96018400  0.34081600  0.63687000  1.0
  F  F28  1  0.03193200  0.40717900  0.08459100  1.0
  F  F29  1  0.73581300  0.99293100  0.25945700  1.0
  F  F30  1  0.53193200  0.59282100  0.41540900  1.0
  F  F31  1  0.30699500  0.25565600  0.02188900  1.0
  F  F32  1  0.19300500  0.25565600  0.52188900  1.0
  F  F33  1  0.69300500  0.74434400  0.97811100  1.0
  F  F34  1  0.53981600  0.34081600  0.13687000  1.0
  F  F35  1  0.80919700  0.53601900  0.25946700  1.0