# generated using pymatgen
data_CrNiP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95318596
_cell_length_b   5.95318509
_cell_length_c   3.50540018
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99872262
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrNiP
_chemical_formula_sum   'Cr3 Ni3 P3'
_cell_volume   107.59018668
_cell_formula_units_Z   3
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  -0.00002677  0.40315811  0.50000000  1.0
  Cr  Cr1  1  0.59689040  0.59689533  0.50000000  1.0
  Cr  Cr2  1  0.40318719  -0.00002036  0.50000000  1.0
  Ni  Ni3  1  -0.00002316  0.74444924  -0.00000000  1.0
  Ni  Ni4  1  0.25552714  0.25553237  -0.00000000  1.0
  Ni  Ni5  1  0.74445161  -0.00001531  -0.00000000  1.0
  P  P6  1  0.33335067  0.66669410  -0.00000000  1.0
  P  P7  1  0.66668391  0.33332922  -0.00000000  1.0
  P  P8  1  -0.00004099  -0.00002171  0.50000000  1.0