# generated using pymatgen
data_LiCrB3(HO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.21487500
_cell_length_b   11.65191300
_cell_length_c   14.16395500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrB3(HO3)3
_chemical_formula_sum   'Li8 Cr8 B24 H24 O72'
_cell_volume   1520.79690477
_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  0.17011300  0.00000000  0.25000000  1
  Li  Li1  1  0.50195200  0.00000000  0.25000000  1
  Li  Li2  1  0.49804800  0.00000000  0.75000000  1
  Li  Li3  1  0.82988700  0.00000000  0.75000000  1
  Li  Li4  1  0.67011300  0.50000000  0.25000000  1
  Li  Li5  1  0.99804800  0.50000000  0.75000000  1
  Li  Li6  1  0.32988700  0.50000000  0.75000000  1
  Li  Li7  1  0.00195200  0.50000000  0.25000000  1
  Cr  Cr8  1  0.34294500  0.23732700  0.32668800  1
  Cr  Cr9  1  0.65705500  0.23732700  0.82668800  1
  Cr  Cr10  1  0.15705500  0.26267300  0.82668800  1
  Cr  Cr11  1  0.84294500  0.26267300  0.32668800  1
  Cr  Cr12  1  0.15705500  0.73732700  0.67331200  1
  Cr  Cr13  1  0.84294500  0.73732700  0.17331200  1
  Cr  Cr14  1  0.34294500  0.76267300  0.17331200  1
  Cr  Cr15  1  0.65705500  0.76267300  0.67331200  1
  B  B16  1  0.03143200  0.14716700  0.08166500  1
  B  B17  1  0.96856800  0.14716700  0.58166500  1
  B  B18  1  0.53079800  0.14571300  0.07521200  1
  B  B19  1  0.46920200  0.14571300  0.57521200  1
  B  B20  1  0.09127300  0.24448400  0.44573100  1
  B  B21  1  0.90872700  0.24448400  0.94573100  1
  B  B22  1  0.40872700  0.25551600  0.94573100  1
  B  B23  1  0.59127300  0.25551600  0.44573100  1
  B  B24  1  0.03079800  0.35428700  0.07521200  1
  B  B25  1  0.96920200  0.35428700  0.57521200  1
  B  B26  1  0.53143200  0.35283300  0.08166500  1
  B  B27  1  0.46856800  0.35283300  0.58166500  1
  B  B28  1  0.46856800  0.64716700  0.91833500  1
  B  B29  1  0.53143200  0.64716700  0.41833500  1
  B  B30  1  0.03079800  0.64571300  0.42478800  1
  B  B31  1  0.96920200  0.64571300  0.92478800  1
  B  B32  1  0.40872700  0.74448400  0.55426900  1
  B  B33  1  0.59127300  0.74448400  0.05426900  1
  B  B34  1  0.09127300  0.75551600  0.05426900  1
  B  B35  1  0.90872700  0.75551600  0.55426900  1
  B  B36  1  0.46920200  0.85428700  0.92478800  1
  B  B37  1  0.53079800  0.85428700  0.42478800  1
  B  B38  1  0.03143200  0.85283300  0.41833500  1
  B  B39  1  0.96856800  0.85283300  0.91833500  1
  H  H40  1  0.06321100  0.98078000  0.08417600  1
  H  H41  1  0.93678900  0.98078000  0.58417600  1
  H  H42  1  0.55994100  0.02404100  0.42302800  1
  H  H43  1  0.44005900  0.02404100  0.92302800  1
  H  H44  1  0.28615600  0.19763900  0.69862100  1
  H  H45  1  0.71384400  0.19763900  0.19862100  1
  H  H46  1  0.21384400  0.30236100  0.19862100  1
  H  H47  1  0.78615600  0.30236100  0.69862100  1
  H  H48  1  0.05994100  0.47595900  0.42302800  1
  H  H49  1  0.94005900  0.47595900  0.92302800  1
  H  H50  1  0.56321100  0.51922000  0.08417600  1
  H  H51  1  0.43678900  0.51922000  0.58417600  1
  H  H52  1  0.43678900  0.48078000  0.91582400  1
  H  H53  1  0.56321100  0.48078000  0.41582400  1
  H  H54  1  0.05994100  0.52404100  0.07697200  1
  H  H55  1  0.94005900  0.52404100  0.57697200  1
  H  H56  1  0.78615600  0.69763900  0.80137900  1
  H  H57  1  0.21384400  0.69763900  0.30137900  1
  H  H58  1  0.28615600  0.80236100  0.80137900  1
  H  H59  1  0.71384400  0.80236100  0.30137900  1
  H  H60  1  0.44005900  0.97595900  0.57697200  1
  H  H61  1  0.55994100  0.97595900  0.07697200  1
  H  H62  1  0.06321100  0.01922000  0.41582400  1
  H  H63  1  0.93678900  0.01922000  0.91582400  1
  O  O64  1  0.56961700  0.04465100  0.11872700  1
  O  O65  1  0.43038300  0.04465100  0.61872700  1
  O  O66  1  0.08203700  0.04868000  0.12454200  1
  O  O67  1  0.91796300  0.04868000  0.62454200  1
  O  O68  1  0.33489000  0.10412900  0.28716300  1
  O  O69  1  0.66511000  0.10412900  0.78716300  1
  O  O70  1  0.94807600  0.14221300  0.00198000  1
  O  O71  1  0.05192400  0.14221300  0.50198000  1
  O  O72  1  0.54166200  0.14730800  0.49125000  1
  O  O73  1  0.45833800  0.14730800  0.99125000  1
  O  O74  1  0.78372100  0.16119000  0.24320100  1
  O  O75  1  0.21627900  0.16119000  0.74320100  1
  O  O76  1  0.02649800  0.23206800  0.35018900  1
  O  O77  1  0.97350200  0.23206800  0.85018900  1
  O  O78  1  0.24933900  0.25351500  0.43375400  1
  O  O79  1  0.75066100  0.25351500  0.93375400  1
  O  O80  1  0.43164600  0.24696100  0.62227400  1
  O  O81  1  0.56835400  0.24696100  0.12227400  1
  O  O82  1  0.06835400  0.25303900  0.12227400  1
  O  O83  1  0.93164600  0.25303900  0.62227400  1
  O  O84  1  0.74933900  0.24648500  0.43375400  1
  O  O85  1  0.25066100  0.24648500  0.93375400  1
  O  O86  1  0.47350200  0.26793200  0.85018900  1
  O  O87  1  0.52649800  0.26793200  0.35018900  1
  O  O88  1  0.28372100  0.33881000  0.24320100  1
  O  O89  1  0.71627900  0.33881000  0.74320100  1
  O  O90  1  0.04166200  0.35269200  0.49125000  1
  O  O91  1  0.95833800  0.35269200  0.99125000  1
  O  O92  1  0.55192400  0.35778700  0.50198000  1
  O  O93  1  0.44807600  0.35778700  0.00198000  1
  O  O94  1  0.83489000  0.39587100  0.28716300  1
  O  O95  1  0.16511000  0.39587100  0.78716300  1
  O  O96  1  0.58203700  0.45132000  0.12454200  1
  O  O97  1  0.41796300  0.45132000  0.62454200  1
  O  O98  1  0.06961700  0.45534900  0.11872700  1
  O  O99  1  0.93038300  0.45534900  0.61872700  1
  O  O100  1  0.06961700  0.54465100  0.38127300  1
  O  O101  1  0.93038300  0.54465100  0.88127300  1
  O  O102  1  0.58203700  0.54868000  0.37545800  1
  O  O103  1  0.41796300  0.54868000  0.87545800  1
  O  O104  1  0.83489000  0.60412900  0.21283700  1
  O  O105  1  0.16511000  0.60412900  0.71283700  1
  O  O106  1  0.44807600  0.64221300  0.49802000  1
  O  O107  1  0.55192400  0.64221300  0.99802000  1
  O  O108  1  0.04166200  0.64730800  0.00875000  1
  O  O109  1  0.95833800  0.64730800  0.50875000  1
  O  O110  1  0.28372100  0.66119000  0.25679900  1
  O  O111  1  0.71627900  0.66119000  0.75679900  1
  O  O112  1  0.47350200  0.73206800  0.64981100  1
  O  O113  1  0.52649800  0.73206800  0.14981100  1
  O  O114  1  0.25066100  0.75351500  0.56624600  1
  O  O115  1  0.74933900  0.75351500  0.06624600  1
  O  O116  1  0.93164600  0.74696100  0.87772600  1
  O  O117  1  0.06835400  0.74696100  0.37772600  1
  O  O118  1  0.43164600  0.75303900  0.87772600  1
  O  O119  1  0.56835400  0.75303900  0.37772600  1
  O  O120  1  0.24933900  0.74648500  0.06624600  1
  O  O121  1  0.75066100  0.74648500  0.56624600  1
  O  O122  1  0.02649800  0.76793200  0.14981100  1
  O  O123  1  0.97350200  0.76793200  0.64981100  1
  O  O124  1  0.21627900  0.83881000  0.75679900  1
  O  O125  1  0.78372100  0.83881000  0.25679900  1
  O  O126  1  0.45833800  0.85269200  0.50875000  1
  O  O127  1  0.54166200  0.85269200  0.00875000  1
  O  O128  1  0.05192400  0.85778700  0.99802000  1
  O  O129  1  0.94807600  0.85778700  0.49802000  1
  O  O130  1  0.33489000  0.89587100  0.21283700  1
  O  O131  1  0.66511000  0.89587100  0.71283700  1
  O  O132  1  0.08203700  0.95132000  0.37545800  1
  O  O133  1  0.91796300  0.95132000  0.87545800  1
  O  O134  1  0.43038300  0.95534900  0.88127300  1
  O  O135  1  0.56961700  0.95534900  0.38127300  1
