# generated using pymatgen
data_Li4Mn3Ni3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.45771000
_cell_length_b   8.55010166
_cell_length_c   8.55893080
_cell_angle_alpha   62.35464524
_cell_angle_beta   62.74566381
_cell_angle_gamma   62.72286474
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Ni3(PO4)6
_chemical_formula_sum   'Li4 Mn3 Ni3 P6 O24'
_cell_volume   463.05212743
_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
  Li  Li0  1  0.25067400  0.64574300  0.85125700  1
  Li  Li1  1  0.72604400  0.35368800  0.14583000  1
  Li  Li2  1  0.35552900  0.14356700  0.72577800  1
  Li  Li3  1  0.14462700  0.72287900  0.35500800  1
  Mn  Mn4  1  0.98320400  0.00111400  0.99662800  1
  Mn  Mn5  1  0.14559500  0.14714700  0.15186200  1
  Mn  Mn6  1  0.51236900  0.49929000  0.49511900  1
  Ni  Ni7  1  0.64307900  0.64708100  0.64378300  1
  Ni  Ni8  1  0.85700700  0.85369700  0.85232500  1
  Ni  Ni9  1  0.35562300  0.34999500  0.35373800  1
  P  P10  1  0.95293700  0.54875500  0.25507400  1
  P  P11  1  0.54893600  0.25238900  0.95404000  1
  P  P12  1  0.25314600  0.95282700  0.55000700  1
  P  P13  1  0.75477900  0.04413500  0.45585500  1
  P  P14  1  0.44792000  0.75285700  0.04309500  1
  P  P15  1  0.05167900  0.45628600  0.75551500  1
  O  O16  1  0.52639400  0.31457800  0.10654400  1
  O  O17  1  0.31977200  0.10379500  0.52360300  1
  O  O18  1  0.10586800  0.51804600  0.32397100  1
  O  O19  1  0.95257300  0.73146600  0.08579500  1
  O  O20  1  0.98893100  0.38439300  0.19426700  1
  O  O21  1  0.75852400  0.56632600  0.40377800  1
  O  O22  1  0.73832900  0.09643200  0.92858500  1
  O  O23  1  0.54072800  0.41585800  0.76854200  1
  O  O24  1  0.82219600  0.01064800  0.60649400  1
  O  O25  1  0.40068100  0.75536000  0.56745700  1
  O  O26  1  0.91296400  0.06981500  0.25321100  1
  O  O27  1  0.61063800  0.81287000  0.99382800  1
  O  O28  1  0.38315200  0.18629100  0.99868900  1
  O  O29  1  0.09909600  0.92857300  0.74403000  1
  O  O30  1  0.60162600  0.24211400  0.42810000  1
  O  O31  1  0.19004000  0.99016900  0.38724400  1
  O  O32  1  0.42870800  0.59904900  0.24017000  1
  O  O33  1  0.24795500  0.91339300  0.07265100  1
  O  O34  1  0.24726500  0.42285200  0.60074600  1
  O  O35  1  0.04042200  0.60359800  0.81635800  1
  O  O36  1  0.06674600  0.25561400  0.91616600  1
  O  O37  1  0.88456300  0.49604100  0.70588600  1
  O  O38  1  0.69780800  0.88924100  0.47840800  1
  O  O39  1  0.45187600  0.69902400  0.89356200  1
