# generated using pymatgen
data_Li3Cu2Ni5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02385069
_cell_length_b   5.03365925
_cell_length_c   28.70152256
_cell_angle_alpha   85.60012511
_cell_angle_beta   93.89759895
_cell_angle_gamma   63.27841216
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Cu2Ni5O12
_chemical_formula_sum   'Li9 Cu6 Ni15 O36'
_cell_volume   642.09513040
_cell_formula_units_Z   3
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  0.65145200  0.15335200  0.99790600  1
  Li  Li1  1  0.15405500  0.65134600  0.16843900  1
  Li  Li2  1  0.64854700  0.15635500  0.66540100  1
  Li  Li3  1  0.65216600  0.15435400  0.33108500  1
  Li  Li4  1  0.83446200  0.35197700  0.83307300  1
  Li  Li5  1  0.83636000  0.35029400  0.50020000  1
  Li  Li6  1  0.93517600  0.90928900  0.91533200  1
  Li  Li7  1  0.93424100  0.90795000  0.58258900  1
  Li  Li8  1  0.92283500  0.92540100  0.24964900  1
  Cu  Cu9  1  0.26349400  0.25733300  0.91654300  1
  Cu  Cu10  1  0.26126600  0.25603100  0.58343500  1
  Cu  Cu11  1  0.25079500  0.25105800  0.25004100  1
  Cu  Cu12  1  0.74028600  0.74200000  0.74990600  1
  Cu  Cu13  1  0.74374300  0.74265600  0.41633300  1
  Cu  Cu14  1  0.73664500  0.74105200  0.08331700  1
  Ni  Ni15  1  0.08331400  0.07095200  0.75029300  1
  Ni  Ni16  1  0.08524300  0.07273600  0.41655100  1
  Ni  Ni17  1  0.07990200  0.08456100  0.08326500  1
  Ni  Ni18  1  0.40456300  0.41766600  0.75017200  1
  Ni  Ni19  1  0.40537500  0.42062500  0.41671900  1
  Ni  Ni20  1  0.58924800  0.59380600  0.91673700  1
  Ni  Ni21  1  0.40790100  0.41339300  0.08290300  1
  Ni  Ni22  1  0.58776100  0.59117500  0.58380100  1
  Ni  Ni23  1  0.50349700  0.99499700  0.83431900  1
  Ni  Ni24  1  0.59000000  0.59159700  0.25000000  1
  Ni  Ni25  1  0.50513300  0.99881300  0.50065100  1
  Ni  Ni26  1  0.99712300  0.51477800  0.99853200  1
  Ni  Ni27  1  0.50867500  0.99939900  0.16780400  1
  Ni  Ni28  1  0.99548500  0.51358000  0.66594600  1
  Ni  Ni29  1  0.99709000  0.50982100  0.33209100  1
  O  O30  1  0.17539300  0.31044200  0.79466700  1
  O  O31  1  0.00851700  0.78143700  0.71232000  1
  O  O32  1  0.32387700  0.19395200  0.70645800  1
  O  O33  1  0.16535500  0.31899200  0.46081900  1
  O  O34  1  0.31556200  0.51674200  0.95334500  1
  O  O35  1  0.01362000  0.77879500  0.37872900  1
  O  O36  1  0.32827800  0.19355600  0.37294000  1
  O  O37  1  0.18806500  0.32984000  0.12866900  1
  O  O38  1  0.31622700  0.51460300  0.62045500  1
  O  O39  1  0.54754900  0.29164500  0.88187600  1
  O  O40  1  0.25845300  0.95903600  0.88188200  1
  O  O41  1  0.01314500  0.77355800  0.04611400  1
  O  O42  1  0.32577300  0.19324300  0.03777600  1
  O  O43  1  0.31001900  0.51030800  0.28635500  1
  O  O44  1  0.54777000  0.28467100  0.54817700  1
  O  O45  1  0.25503800  0.95771900  0.54902800  1
  O  O46  1  0.75409800  0.02951600  0.78691100  1
  O  O47  1  0.46767200  0.70017400  0.78587100  1
  O  O48  1  0.51103300  0.31322500  0.21370800  1
  O  O49  1  0.26451600  0.94050300  0.21517600  1
  O  O50  1  0.75894600  0.03029400  0.45347700  1
  O  O51  1  0.46849000  0.70699700  0.45259800  1
  O  O52  1  0.72382700  0.44811800  0.71551400  1
  O  O53  1  0.67496600  0.82410600  0.95870400  1
  O  O54  1  0.94683600  0.27217700  0.95121000  1
  O  O55  1  0.76725800  0.01767100  0.12010100  1
  O  O56  1  0.44302500  0.72841700  0.11811800  1
  O  O57  1  0.81594400  0.66270800  0.87326700  1
  O  O58  1  0.72513100  0.44989100  0.38165600  1
  O  O59  1  0.67073700  0.82340700  0.62568500  1
  O  O60  1  0.94616200  0.27025500  0.61851900  1
  O  O61  1  0.81902400  0.65451200  0.54114100  1
  O  O62  1  0.72470400  0.44921400  0.04858700  1
  O  O63  1  0.67143100  0.82186900  0.29249800  1
  O  O64  1  0.93791500  0.26390900  0.28484700  1
  O  O65  1  0.82025800  0.67571000  0.20732000  1
