# generated using pymatgen
data_TiMn2Fe3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61820090
_cell_length_b   8.61820090
_cell_length_c   8.61820130
_cell_angle_alpha   60.29158849
_cell_angle_beta   60.29158849
_cell_angle_gamma   60.29158499
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiMn2Fe3(PO4)6
_chemical_formula_sum   'Ti1 Mn2 Fe3 P6 O24'
_cell_volume   455.60790469
_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  0.14517800  0.14517800  0.14517800  1.0
  Mn  Mn1  1  0.99890400  0.99890400  0.99890400  1.0
  Mn  Mn2  1  0.49935200  0.49935200  0.49935200  1.0
  Fe  Fe3  1  0.85450000  0.85450000  0.85450000  1.0
  Fe  Fe4  1  0.64530600  0.64530600  0.64530600  1.0
  Fe  Fe5  1  0.35474500  0.35474500  0.35474500  1.0
  P  P6  1  0.75006300  0.45622900  0.04446300  1.0
  P  P7  1  0.45622900  0.04446300  0.75006300  1.0
  P  P8  1  0.04446300  0.75006300  0.45622900  1.0
  P  P9  1  0.95610700  0.25054800  0.54432300  1.0
  P  P10  1  0.54432300  0.95610700  0.25054800  1.0
  P  P11  1  0.25054800  0.54432300  0.95610700  1.0
  O  O12  1  0.88771200  0.68862800  0.49191600  1.0
  O  O13  1  0.68862800  0.49191600  0.88771200  1.0
  O  O14  1  0.94012900  0.08803900  0.73744300  1.0
  O  O15  1  0.49191600  0.88771200  0.68862800  1.0
  O  O16  1  0.00621100  0.18472000  0.38138900  1.0
  O  O17  1  0.76105400  0.41187300  0.55245000  1.0
  O  O18  1  0.73744300  0.94012900  0.08803900  1.0
  O  O19  1  0.55245000  0.76105400  0.41187300  1.0
  O  O20  1  0.81282500  0.61259800  0.00605700  1.0
  O  O21  1  0.41187300  0.55245000  0.76105400  1.0
  O  O22  1  0.91363200  0.25986900  0.06319500  1.0
  O  O23  1  0.61259800  0.00605700  0.81282500  1.0
  O  O24  1  0.38138900  0.00621100  0.18472000  1.0
  O  O25  1  0.08803900  0.73744300  0.94012900  1.0
  O  O26  1  0.58857500  0.43913500  0.24116700  1.0
  O  O27  1  0.18472000  0.38138900  0.00621100  1.0
  O  O28  1  0.43913500  0.24116700  0.58857500  1.0
  O  O29  1  0.25986900  0.06319500  0.91363200  1.0
  O  O30  1  0.24116700  0.58857500  0.43913500  1.0
  O  O31  1  0.00605700  0.81282500  0.61259800  1.0
  O  O32  1  0.50434700  0.11054600  0.31677700  1.0
  O  O33  1  0.06319500  0.91363200  0.25986900  1.0
  O  O34  1  0.31677700  0.50434700  0.11054600  1.0
  O  O35  1  0.11054600  0.31677700  0.50434700  1.0