# generated using pymatgen
data_Li2Zr7Fe(PO4)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.98493100
_cell_length_b   9.07593975
_cell_length_c   12.54641670
_cell_angle_alpha   90.11687115
_cell_angle_beta   90.01758638
_cell_angle_gamma   90.04463243
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Zr7Fe(PO4)12
_chemical_formula_sum   'Li2 Zr7 Fe1 P12 O48'
_cell_volume   1023.11629623
_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  0.78400200  0.77706800  0.81923800  1
  Li  Li1  1  0.78048100  0.72078800  0.18805500  1
  Zr  Zr2  1  0.25166500  0.46706800  0.62053600  1
  Zr  Zr3  1  0.25217400  0.03749900  0.37682400  1
  Zr  Zr4  1  0.25180500  0.96459800  0.88159000  1
  Zr  Zr5  1  0.25125700  0.53476200  0.12009600  1
  Zr  Zr6  1  0.74753800  0.45324400  0.88316200  1
  Zr  Zr7  1  0.74718500  0.04581400  0.12229500  1
  Zr  Zr8  1  0.74827800  0.97234600  0.61288000  1
  Fe  Fe9  1  0.74883000  0.53599900  0.38581100  1
  P  P10  1  0.03226300  0.75062900  0.49385700  1
  P  P11  1  0.10338300  0.60895100  0.85721600  1
  P  P12  1  0.10359500  0.89051600  0.14411100  1
  P  P13  1  0.40379900  0.39328800  0.35782400  1
  P  P14  1  0.38780800  0.10608000  0.64311400  1
  P  P15  1  0.45805300  0.24956900  0.00125700  1
  P  P16  1  0.54267700  0.74939700  0.99976200  1
  P  P17  1  0.60513400  0.88174100  0.35433800  1
  P  P18  1  0.61663300  0.60659800  0.64464500  1
  P  P19  1  0.88758900  0.40115300  0.15088900  1
  P  P20  1  0.89249000  0.10128500  0.85742900  1
  P  P21  1  0.96364400  0.25694000  0.49389200  1
  O  O22  1  0.06074500  0.35211200  0.56839400  1
  O  O23  1  0.06389300  0.16144200  0.42267800  1
  O  O24  1  0.06153000  0.08904800  0.84804400  1
  O  O25  1  0.05767000  0.41727100  0.15955700  1
  O  O26  1  0.13039700  0.85132700  0.42553400  1
  O  O27  1  0.13084000  0.64887500  0.56156200  1
  O  O28  1  0.15518100  0.56205300  0.96862500  1
  O  O29  1  0.15497800  0.93538500  0.03228000  1
  O  O30  1  0.15144300  0.76829200  0.83338900  1
  O  O31  1  0.15617900  0.73294100  0.16915300  1
  O  O32  1  0.17078400  0.50488500  0.77250900  1
  O  O33  1  0.16915300  0.00097700  0.22527000  1
  O  O34  1  0.32103400  0.00099600  0.72610000  1
  O  O35  1  0.33646600  0.49617000  0.27315400  1
  O  O36  1  0.36240100  0.23107900  0.33549000  1
  O  O37  1  0.34474400  0.26753700  0.66633100  1
  O  O38  1  0.34510300  0.43736700  0.46826800  1
  O  O39  1  0.33143400  0.06256400  0.53191100  1
  O  O40  1  0.36112000  0.15565000  0.92755500  1
  O  O41  1  0.35745000  0.34199700  0.07360900  1
  O  O42  1  0.43534700  0.89942400  0.34745800  1
  O  O43  1  0.44497000  0.59524000  0.64899100  1
  O  O44  1  0.44585400  0.85484000  0.93376700  1
  O  O45  1  0.44475100  0.64376800  0.06490600  1
  O  O46  1  0.55703000  0.35022700  0.93181300  1
  O  O47  1  0.55788800  0.15068300  0.07169000  1
  O  O48  1  0.57498800  0.40926400  0.35387600  1
  O  O49  1  0.55926700  0.09107800  0.64825500  1
  O  O50  1  0.64585800  0.66433400  0.92090500  1
  O  O51  1  0.64755700  0.83408100  0.07746700  1
  O  O52  1  0.65741000  0.92160500  0.46811200  1
  O  O53  1  0.67181000  0.57262200  0.53212800  1
  O  O54  1  0.66763700  0.76471500  0.67878800  1
  O  O55  1  0.65561400  0.72385400  0.32479200  1
  O  O56  1  0.68104400  0.49781500  0.72742000  1
  O  O57  1  0.67933100  0.98859000  0.27425700  1
  O  O58  1  0.82066000  0.98961900  0.77707400  1
  O  O59  1  0.81602100  0.51329400  0.22919000  1
  O  O60  1  0.84440000  0.26017300  0.83116000  1
  O  O61  1  0.84255500  0.24018200  0.17551100  1
  O  O62  1  0.83298300  0.44024700  0.03747200  1
  O  O63  1  0.83844300  0.06121700  0.97027000  1
  O  O64  1  0.86540700  0.35723300  0.42484000  1
  O  O65  1  0.86242800  0.15663100  0.56250600  1
  O  O66  1  0.93074600  0.89401000  0.15260400  1
  O  O67  1  0.93039900  0.60246500  0.84962900  1
  O  O68  1  0.93456500  0.84521200  0.56788300  1
  O  O69  1  0.93504200  0.65427300  0.41900500  1
