# generated using pymatgen
data_TiMn5(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64101098
_cell_length_b   8.64101098
_cell_length_c   8.64101067
_cell_angle_alpha   59.86510660
_cell_angle_beta   59.86510660
_cell_angle_gamma   59.86510105
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiMn5(PO4)6
_chemical_formula_sum   'Ti1 Mn5 P6 O24'
_cell_volume   454.82805360
_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  0.85526800  0.85526800  0.85526800  1.0
  Mn  Mn1  1  0.00045600  0.00045600  0.00045600  1.0
  Mn  Mn2  1  0.35591200  0.35591200  0.35591200  1.0
  Mn  Mn3  1  0.50077300  0.50077300  0.50077300  1.0
  Mn  Mn4  1  0.14486700  0.14486700  0.14486700  1.0
  Mn  Mn5  1  0.64434500  0.64434500  0.64434500  1.0
  P  P6  1  0.75064600  0.04227600  0.45581400  1.0
  P  P7  1  0.04227600  0.45581400  0.75064600  1.0
  P  P8  1  0.45581400  0.75064600  0.04227600  1.0
  P  P9  1  0.54083300  0.25126000  0.95862800  1.0
  P  P10  1  0.95862800  0.54083300  0.25126000  1.0
  P  P11  1  0.25126000  0.95862800  0.54083300  1.0
  O  O12  1  0.88454500  0.48600200  0.69604500  1.0
  O  O13  1  0.48600200  0.69604500  0.88454500  1.0
  O  O14  1  0.69604500  0.88454500  0.48600200  1.0
  O  O15  1  0.91690400  0.05861400  0.26282900  1.0
  O  O16  1  0.81125300  0.99574500  0.61987600  1.0
  O  O17  1  0.58781500  0.23663400  0.44655000  1.0
  O  O18  1  0.05861400  0.26282900  0.91690400  1.0
  O  O19  1  0.23663400  0.44655000  0.58781500  1.0
  O  O20  1  0.38196900  0.19590400  0.99044900  1.0
  O  O21  1  0.44655000  0.58781500  0.23663400  1.0
  O  O22  1  0.73618000  0.08461900  0.93868100  1.0
  O  O23  1  0.99044900  0.38196900  0.19590400  1.0
  O  O24  1  0.99574500  0.61987600  0.81125300  1.0
  O  O25  1  0.26282900  0.91690400  0.05861400  1.0
  O  O26  1  0.55817200  0.41409300  0.76236300  1.0
  O  O27  1  0.61987600  0.81125300  0.99574500  1.0
  O  O28  1  0.76236300  0.55817200  0.41409300  1.0
  O  O29  1  0.93868100  0.73618000  0.08461900  1.0
  O  O30  1  0.41409300  0.76236300  0.55817200  1.0
  O  O31  1  0.19590400  0.99044900  0.38196900  1.0
  O  O32  1  0.08461900  0.93868100  0.73618000  1.0
  O  O33  1  0.30668300  0.11542400  0.51157200  1.0
  O  O34  1  0.51157200  0.30668300  0.11542400  1.0
  O  O35  1  0.11542400  0.51157200  0.30668300  1.0