# generated using pymatgen
data_CrP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19715700
_cell_length_b   10.75897536
_cell_length_c   5.72203848
_cell_angle_alpha   90.00000000
_cell_angle_beta   110.42741691
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrP4
_chemical_formula_sum   'Cr4 P16'
_cell_volume   299.83370579
_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
  Cr  Cr0  1  0.50000000  0.56024600  0.25000000  1
  Cr  Cr1  1  0.00000000  0.93975400  0.75000000  1
  Cr  Cr2  1  0.00000000  0.06024600  0.25000000  1
  Cr  Cr3  1  0.50000000  0.43975400  0.75000000  1
  P  P4  1  0.22696500  0.71869900  0.30906600  1
  P  P5  1  0.77303500  0.71869900  0.19093400  1
  P  P6  1  0.72792100  0.91059600  0.32370900  1
  P  P7  1  0.27207900  0.91059600  0.17629100  1
  P  P8  1  0.77207900  0.58940400  0.67629100  1
  P  P9  1  0.22792100  0.58940400  0.82370900  1
  P  P10  1  0.72696500  0.78130100  0.80906600  1
  P  P11  1  0.27303500  0.78130100  0.69093400  1
  P  P12  1  0.72696500  0.21869900  0.30906600  1
  P  P13  1  0.27303500  0.21869900  0.19093400  1
  P  P14  1  0.22792100  0.41059600  0.32370900  1
  P  P15  1  0.77207900  0.41059600  0.17629100  1
  P  P16  1  0.27207900  0.08940400  0.67629100  1
  P  P17  1  0.72792100  0.08940400  0.82370900  1
  P  P18  1  0.22696500  0.28130100  0.80906600  1
  P  P19  1  0.77303500  0.28130100  0.69093400  1
