# generated using pymatgen
data_Ti3Mn2Cu(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.63639995
_cell_length_b   8.63639995
_cell_length_c   8.63639938
_cell_angle_alpha   60.16823670
_cell_angle_beta   60.16823670
_cell_angle_gamma   60.16823584
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Mn2Cu(PO4)6
_chemical_formula_sum   'Ti3 Mn2 Cu1 P6 O24'
_cell_volume   457.23013839
_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  0.14367600  0.14367600  0.14367500  1.0
  Ti  Ti1  1  0.35379200  0.35379200  0.35379200  1.0
  Ti  Ti2  1  0.64708800  0.64708800  0.64708800  1.0
  Mn  Mn3  1  0.99536500  0.99536500  0.99536500  1.0
  Mn  Mn4  1  0.49915400  0.49915400  0.49915400  1.0
  Cu  Cu5  1  0.85353000  0.85353000  0.85353000  1.0
  P  P6  1  0.95554700  0.54206000  0.25180100  1.0
  P  P7  1  0.25180100  0.95554700  0.54206000  1.0
  P  P8  1  0.54206000  0.25180100  0.95554700  1.0
  P  P9  1  0.45704800  0.75220800  0.04603000  1.0
  P  P10  1  0.75220800  0.04603000  0.45704800  1.0
  P  P11  1  0.04603000  0.45704800  0.75220800  1.0
  O  O12  1  0.48679200  0.32373600  0.11467300  1.0
  O  O13  1  0.11467300  0.48679200  0.32373600  1.0
  O  O14  1  0.26014900  0.91332900  0.05901800  1.0
  O  O15  1  0.32373600  0.11467300  0.48679200  1.0
  O  O16  1  0.60970000  0.80826900  0.01945300  1.0
  O  O17  1  0.43019600  0.58570500  0.23832000  1.0
  O  O18  1  0.91332900  0.05901800  0.26014900  1.0
  O  O19  1  0.58570500  0.23832000  0.43019600  1.0
  O  O20  1  0.00127200  0.37830300  0.19019200  1.0
  O  O21  1  0.23832000  0.43019600  0.58570500  1.0
  O  O22  1  0.94799700  0.73243500  0.09389700  1.0
  O  O23  1  0.19019200  0.00127200  0.37830300  1.0
  O  O24  1  0.80826900  0.01945300  0.60970000  1.0
  O  O25  1  0.05901800  0.26014900  0.91332900  1.0
  O  O26  1  0.76365400  0.55230100  0.41815500  1.0
  O  O27  1  0.01945300  0.60970000  0.80826900  1.0
  O  O28  1  0.41815500  0.76365400  0.55230100  1.0
  O  O29  1  0.09389700  0.94799700  0.73243500  1.0
  O  O30  1  0.55230100  0.41815500  0.76365400  1.0
  O  O31  1  0.37830300  0.19019200  0.00127200  1.0
  O  O32  1  0.69236500  0.87909000  0.50370300  1.0
  O  O33  1  0.73243500  0.09389700  0.94799700  1.0
  O  O34  1  0.87909000  0.50370300  0.69236500  1.0
  O  O35  1  0.50370300  0.69236500  0.87909000  1.0