data_[Mg1V1Cr1P2O8F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2231]
_cell_length_b [5.4080]
_cell_length_c [7.3957]
_cell_angle_alpha [107.5483]
_cell_angle_beta [109.0925]
_cell_angle_gamma [97.2185]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [MgVCrP2(O4F)2]
_chemical_formula_sum '[Mg1 V1 Cr1 P2 O8 F2]'
_cell_volume [182.2997]
_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
[
  Mg  Mg0  1  0.7437  0.3917  0.8227  1.0
  V  V1  1  0.0092  0.0056  0.0096  1.0
  Cr  Cr2  1  0.0066  0.9957  0.4897  1.0
  P  P3  1  0.3184  0.6439  0.7561  1.0
  P  P4  1  0.6727  0.3626  0.2383  1.0
  O  O5  1  0.0993  0.6549  0.8597  1.0
  O  O6  1  0.2724  0.8037  0.6161  1.0
  O  O7  1  0.3200  0.3436  0.6542  1.0
  O  O8  1  0.3638  0.2406  0.0894  1.0
  O  O9  1  0.6276  0.7464  0.9187  1.0
  O  O10  1  0.7107  0.6628  0.3413  1.0
  O  O11  1  0.7670  0.2283  0.3964  1.0
  O  O12  1  0.8370  0.3099  0.0882  1.0
  F  F13  1  0.1337  0.9333  0.2673  1.0
  F  F14  1  0.8815  0.0747  0.7310  1.0
]