# generated using pymatgen
data_LiCrPH2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03217000
_cell_length_b   10.40504600
_cell_length_c   17.28840900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrPH2O5
_chemical_formula_sum   'Li8 Cr8 P8 H16 O40'
_cell_volume   905.22040941
_cell_formula_units_Z   8
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  0.46537700  0.17438900  0.49482800  1
  Li  Li1  1  0.53462300  0.17438900  0.99482800  1
  Li  Li2  1  0.91118600  0.39807900  0.24589400  1
  Li  Li3  1  0.08881400  0.39807900  0.74589400  1
  Li  Li4  1  0.46537700  0.67438900  0.00517200  1
  Li  Li5  1  0.53462300  0.67438900  0.50517200  1
  Li  Li6  1  0.08881400  0.89807900  0.75410600  1
  Li  Li7  1  0.91118600  0.89807900  0.25410600  1
  Cr  Cr8  1  0.56031200  0.14642000  0.19100100  1
  Cr  Cr9  1  0.43968800  0.14642000  0.69100100  1
  Cr  Cr10  1  0.87650200  0.42477200  0.44138500  1
  Cr  Cr11  1  0.12349800  0.42477200  0.94138500  1
  Cr  Cr12  1  0.56031200  0.64642000  0.30899900  1
  Cr  Cr13  1  0.43968800  0.64642000  0.80899900  1
  Cr  Cr14  1  0.12349800  0.92477200  0.55861500  1
  Cr  Cr15  1  0.87650200  0.92477200  0.05861500  1
  P  P16  1  0.03018400  0.23273200  0.09107700  1
  P  P17  1  0.96981600  0.23273200  0.59107700  1
  P  P18  1  0.40649000  0.33939800  0.34062400  1
  P  P19  1  0.59351000  0.33939800  0.84062400  1
  P  P20  1  0.03018400  0.73273200  0.40892300  1
  P  P21  1  0.96981600  0.73273200  0.90892300  1
  P  P22  1  0.59351000  0.83939800  0.65937600  1
  P  P23  1  0.40649000  0.83939800  0.15937600  1
  H  H24  1  0.08495700  0.00103200  0.37099300  1
  H  H25  1  0.91504300  0.00103200  0.87099300  1
  H  H26  1  0.63306000  0.05355700  0.38133600  1
  H  H27  1  0.36694000  0.05355700  0.88133600  1
  H  H28  1  0.13734900  0.10971300  0.31039900  1
  H  H29  1  0.86265100  0.10971300  0.81039900  1
  H  H30  1  0.63355100  0.44977800  0.05470000  1
  H  H31  1  0.36644900  0.44977800  0.55470000  1
  H  H32  1  0.08495700  0.50103200  0.12900700  1
  H  H33  1  0.91504300  0.50103200  0.62900700  1
  H  H34  1  0.63306000  0.55355700  0.11866400  1
  H  H35  1  0.36694000  0.55355700  0.61866400  1
  H  H36  1  0.13734900  0.60971300  0.18960100  1
  H  H37  1  0.86265100  0.60971300  0.68960100  1
  H  H38  1  0.63355100  0.94977800  0.44530000  1
  H  H39  1  0.36644900  0.94977800  0.94530000  1
  O  O40  1  0.53217500  0.02437500  0.42688900  1
  O  O41  1  0.46782500  0.02437500  0.92688900  1
  O  O42  1  0.00969700  0.04073800  0.32417200  1
  O  O43  1  0.99030300  0.04073800  0.82417200  1
  O  O44  1  0.87263200  0.12427200  0.04826500  1
  O  O45  1  0.12736800  0.12427200  0.54826500  1
  O  O46  1  0.32663300  0.19441900  0.09349700  1
  O  O47  1  0.67336700  0.19441900  0.59349700  1
  O  O48  1  0.56670400  0.21000000  0.79740100  1
  O  O49  1  0.43329600  0.21000000  0.29740100  1
  O  O50  1  0.90770700  0.24933800  0.17385300  1
  O  O51  1  0.09229300  0.24933800  0.67385300  1
  O  O52  1  0.47518700  0.32334800  0.92412700  1
  O  O53  1  0.52481300  0.32334800  0.42412700  1
  O  O54  1  0.99400400  0.36189900  0.04774200  1
  O  O55  1  0.00599600  0.36189900  0.54774200  1
  O  O56  1  0.11114400  0.37972300  0.34385900  1
  O  O57  1  0.88885600  0.37972300  0.84385900  1
  O  O58  1  0.56685100  0.44642700  0.29743800  1
  O  O59  1  0.43314900  0.44642700  0.79743800  1
  O  O60  1  0.53217500  0.52437500  0.07311100  1
  O  O61  1  0.46782500  0.52437500  0.57311100  1
  O  O62  1  0.00969700  0.54073800  0.17582800  1
  O  O63  1  0.99030300  0.54073800  0.67582800  1
  O  O64  1  0.12736800  0.62427200  0.95173500  1
  O  O65  1  0.87263200  0.62427200  0.45173500  1
  O  O66  1  0.67336700  0.69441900  0.90650300  1
  O  O67  1  0.32663300  0.69441900  0.40650300  1
  O  O68  1  0.43329600  0.71000000  0.20259900  1
  O  O69  1  0.56670400  0.71000000  0.70259900  1
  O  O70  1  0.90770700  0.74933800  0.32614700  1
  O  O71  1  0.09229300  0.74933800  0.82614700  1
  O  O72  1  0.47518700  0.82334800  0.57587300  1
  O  O73  1  0.52481300  0.82334800  0.07587300  1
  O  O74  1  0.99400400  0.86189900  0.45225800  1
  O  O75  1  0.00599600  0.86189900  0.95225800  1
  O  O76  1  0.88885600  0.87972300  0.65614100  1
  O  O77  1  0.11114400  0.87972300  0.15614100  1
  O  O78  1  0.43314900  0.94642700  0.70256200  1
  O  O79  1  0.56685100  0.94642700  0.20256200  1
