# generated using pymatgen
data_LiCa2Mn2Si5HO15
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83088085
_cell_length_b   7.68075858
_cell_length_c   11.73856705
_cell_angle_alpha   106.09768449
_cell_angle_beta   91.98029217
_cell_angle_gamma   94.57846484
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCa2Mn2Si5HO15
_chemical_formula_sum   'Li2 Ca4 Mn4 Si10 H2 O30'
_cell_volume   588.80886152
_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  0.67829043  0.35936608  0.89011098  1
  Li  Li1  1  0.32170957  0.64063392  0.10988902  1
  Ca  Ca2  1  0.86035729  0.19018379  0.05964265  1
  Ca  Ca3  1  0.13964271  0.80981621  0.94035735  1
  Ca  Ca4  1  0.71636489  0.76503466  0.47685053  1
  Ca  Ca5  1  0.28363511  0.23496534  0.52314947  1
  Mn  Mn6  1  0.94044374  0.40691029  0.35340678  1
  Mn  Mn7  1  0.05955626  0.59308971  0.64659322  1
  Mn  Mn8  1  0.81975294  0.95680757  0.76384018  1
  Mn  Mn9  1  0.18024706  0.04319243  0.23615982  1
  Si  Si10  1  0.64961430  0.71890445  0.94860391  1
  Si  Si11  1  0.35038570  0.28109555  0.05139609  1
  Si  Si12  1  0.57574481  0.53579471  0.67949543  1
  Si  Si13  1  0.42425519  0.46420529  0.32050457  1
  Si  Si14  1  0.78359844  0.19290543  0.54995547  1
  Si  Si15  1  0.21640156  0.80709457  0.45004453  1
  Si  Si16  1  0.70440554  0.00202289  0.28169693  1
  Si  Si17  1  0.29559446  0.99797711  0.71830307  1
  Si  Si18  1  0.89236615  0.65695428  0.15417687  1
  Si  Si19  1  0.10763385  0.34304572  0.84582313  1
  H  H20  1  0.51629346  0.08004981  0.87900137  1
  H  H21  1  0.48370654  0.91995019  0.12099863  1
  O  O22  1  0.45287930  0.78541124  0.01138659  1
  O  O23  1  0.54712070  0.21458876  0.98861341  1
  O  O24  1  0.80647749  0.87849711  0.93417633  1
  O  O25  1  0.19352251  0.12150289  0.06582367  1
  O  O26  1  0.58901239  0.55797334  0.82391679  1
  O  O27  1  0.41098761  0.44202666  0.17608321  1
  O  O28  1  0.74636252  0.67427885  0.65230430  1
  O  O29  1  0.25363748  0.32572115  0.34769570  1
  O  O30  1  0.64016777  0.45576859  0.37414093  1
  O  O31  1  0.35983223  0.54423141  0.62585907  1
  O  O32  1  0.61750787  0.31822404  0.62134821  1
  O  O33  1  0.38249213  0.68177596  0.37865179  1
  O  O34  1  0.83789644  0.03946565  0.61015008  1
  O  O35  1  0.16210356  0.96053435  0.38984992  1
  O  O36  1  0.96407565  0.32349373  0.52573942  1
  O  O37  1  0.03592435  0.67650627  0.47426058  1
  O  O38  1  0.66255137  0.06935273  0.42270017  1
  O  O39  1  0.33744863  0.93064727  0.57729983  1
  O  O40  1  0.87730937  0.12399140  0.24333449  1
  O  O41  1  0.12269063  0.87600860  0.75666551  1
  O  O42  1  0.50407749  0.99664027  0.79035106  1
  O  O43  1  0.49592251  0.00335973  0.20964894  1
  O  O44  1  0.76227206  0.79057862  0.25580088  1
  O  O45  1  0.23772794  0.20942138  0.74419912  1
  O  O46  1  0.93258370  0.47767788  0.19069881  1
  O  O47  1  0.06741630  0.52232212  0.80930119  1
  O  O48  1  0.91077716  0.22978563  0.86966495  1
  O  O49  1  0.08922284  0.77021437  0.13033505  1
  O  O50  1  0.75453855  0.59808830  0.02714338  1
  O  O51  1  0.24546145  0.40191170  0.97285662  1
