# generated using pymatgen
data_Ti3Cr2Ni(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61796503
_cell_length_b   8.61796503
_cell_length_c   8.61796499
_cell_angle_alpha   60.11835305
_cell_angle_beta   60.11835305
_cell_angle_gamma   60.11835949
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Cr2Ni(PO4)6
_chemical_formula_sum   'Ti3 Cr2 Ni1 P6 O24'
_cell_volume   453.79754399
_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
  Ti  Ti0  1  0.14442500  0.14442500  0.14442500  1.0
  Ti  Ti1  1  0.35462600  0.35462600  0.35462600  1.0
  Ti  Ti2  1  0.64634000  0.64634000  0.64634000  1.0
  Cr  Cr3  1  0.99734700  0.99734700  0.99734700  1.0
  Cr  Cr4  1  0.49899300  0.49899300  0.49899300  1.0
  Ni  Ni5  1  0.85616600  0.85616600  0.85616600  1.0
  P  P6  1  0.45739700  0.75216800  0.04405300  1.0
  P  P7  1  0.75216800  0.04405300  0.45739700  1.0
  P  P8  1  0.95635000  0.54424400  0.25031000  1.0
  P  P9  1  0.25031000  0.95635000  0.54424400  1.0
  P  P10  1  0.54424400  0.25031000  0.95635000  1.0
  P  P11  1  0.04405300  0.45739700  0.75216800  1.0
  O  O12  1  0.49081700  0.31897000  0.11678000  1.0
  O  O13  1  0.11678000  0.49081700  0.31897000  1.0
  O  O14  1  0.25822400  0.91381200  0.05769700  1.0
  O  O15  1  0.31897000  0.11678000  0.49081700  1.0
  O  O16  1  0.60944500  0.80989200  0.01402800  1.0
  O  O17  1  0.43097800  0.58588300  0.23758000  1.0
  O  O18  1  0.91381200  0.05769700  0.25822400  1.0
  O  O19  1  0.58588300  0.23758000  0.43097800  1.0
  O  O20  1  0.00148700  0.38007800  0.18942800  1.0
  O  O21  1  0.23758000  0.43097800  0.58588300  1.0
  O  O22  1  0.94695300  0.73624600  0.09173700  1.0
  O  O23  1  0.18942800  0.00148700  0.38007800  1.0
  O  O24  1  0.80989200  0.01402800  0.60944500  1.0
  O  O25  1  0.05769700  0.25822400  0.91381200  1.0
  O  O26  1  0.76396300  0.55480800  0.41655100  1.0
  O  O27  1  0.01402800  0.60944500  0.80989200  1.0
  O  O28  1  0.41655100  0.76396300  0.55480800  1.0
  O  O29  1  0.09173700  0.94695300  0.73624600  1.0
  O  O30  1  0.55480800  0.41655100  0.76396300  1.0
  O  O31  1  0.38007800  0.18942800  0.00148700  1.0
  O  O32  1  0.69155600  0.87884400  0.50182200  1.0
  O  O33  1  0.73624600  0.09173700  0.94695300  1.0
  O  O34  1  0.87884400  0.50182200  0.69155600  1.0
  O  O35  1  0.50182200  0.69155600  0.87884400  1.0