# generated using pymatgen
data_Li6Ni2P(CO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.32611760
_cell_length_b   9.32611760
_cell_length_c   9.32611760
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Ni2P(CO4)4
_chemical_formula_sum   'Li12 Ni4 P2 C8 O32'
_cell_volume   573.57163411
_cell_formula_units_Z   2
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  0.28239400  0.28239400  0.71760600  1
  Li  Li1  1  0.96760600  0.53239400  0.53239400  1
  Li  Li2  1  0.71760600  0.28239400  0.71760600  1
  Li  Li3  1  0.28239400  0.71760600  0.28239400  1
  Li  Li4  1  0.53239400  0.96760600  0.96760600  1
  Li  Li5  1  0.53239400  0.53239400  0.96760600  1
  Li  Li6  1  0.71760600  0.28239400  0.28239400  1
  Li  Li7  1  0.71760600  0.71760600  0.28239400  1
  Li  Li8  1  0.96760600  0.53239400  0.96760600  1
  Li  Li9  1  0.53239400  0.96760600  0.53239400  1
  Li  Li10  1  0.28239400  0.71760600  0.71760600  1
  Li  Li11  1  0.96760600  0.96760600  0.53239400  1
  Ni  Ni12  1  0.62500000  0.12500000  0.12500000  1
  Ni  Ni13  1  0.12500000  0.12500000  0.12500000  1
  Ni  Ni14  1  0.12500000  0.12500000  0.62500000  1
  Ni  Ni15  1  0.12500000  0.62500000  0.12500000  1
  P  P16  1  0.50000000  0.50000000  0.50000000  1
  P  P17  1  0.75000000  0.75000000  0.75000000  1
  C  C18  1  0.29426600  0.90191100  0.90191100  1
  C  C19  1  0.90191100  0.29426600  0.90191100  1
  C  C20  1  0.90191100  0.90191100  0.90191100  1
  C  C21  1  0.90191100  0.90191100  0.29426600  1
  C  C22  1  0.34808900  0.34808900  0.95573400  1
  C  C23  1  0.34808900  0.34808900  0.34808900  1
  C  C24  1  0.34808900  0.95573400  0.34808900  1
  C  C25  1  0.95573400  0.34808900  0.34808900  1
  O  O26  1  0.21527300  0.49309200  0.33697600  1
  O  O27  1  0.95465900  0.33697600  0.49309200  1
  O  O28  1  0.29534100  0.03472700  0.91302400  1
  O  O29  1  0.03472700  0.29534100  0.75690800  1
  O  O30  1  0.29534100  0.75690800  0.03472700  1
  O  O31  1  0.56777600  0.56777600  0.29667300  1
  O  O32  1  0.91302400  0.03472700  0.75690800  1
  O  O33  1  0.56777600  0.56777600  0.56777600  1
  O  O34  1  0.56777600  0.29667300  0.56777600  1
  O  O35  1  0.91302400  0.29534100  0.03472700  1
  O  O36  1  0.75690800  0.29534100  0.91302400  1
  O  O37  1  0.29667300  0.56777600  0.56777600  1
  O  O38  1  0.03472700  0.91302400  0.29534100  1
  O  O39  1  0.75690800  0.91302400  0.03472700  1
  O  O40  1  0.91302400  0.75690800  0.29534100  1
  O  O41  1  0.49309200  0.21527300  0.95465900  1
  O  O42  1  0.75690800  0.03472700  0.29534100  1
  O  O43  1  0.33697600  0.49309200  0.95465900  1
  O  O44  1  0.49309200  0.33697600  0.21527300  1
  O  O45  1  0.21527300  0.33697600  0.95465900  1
  O  O46  1  0.95332700  0.68222400  0.68222400  1
  O  O47  1  0.49309200  0.95465900  0.33697600  1
  O  O48  1  0.33697600  0.95465900  0.21527300  1
  O  O49  1  0.68222400  0.95332700  0.68222400  1
  O  O50  1  0.68222400  0.68222400  0.68222400  1
  O  O51  1  0.33697600  0.21527300  0.49309200  1
  O  O52  1  0.68222400  0.68222400  0.95332700  1
  O  O53  1  0.95465900  0.49309200  0.21527300  1
  O  O54  1  0.21527300  0.95465900  0.49309200  1
  O  O55  1  0.95465900  0.21527300  0.33697600  1
  O  O56  1  0.29534100  0.91302400  0.75690800  1
  O  O57  1  0.03472700  0.75690800  0.91302400  1
