# generated using pymatgen
data_Li3Al2CrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10047314
_cell_length_b   8.62988200
_cell_length_c   9.59007968
_cell_angle_alpha   90.00001170
_cell_angle_beta   100.97232119
_cell_angle_gamma   90.00000221
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Al2CrO6
_chemical_formula_sum   'Li12 Al8 Cr4 O24'
_cell_volume   414.40486309
_cell_formula_units_Z   4
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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.25000100  0.00000000  0.75000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Li  Li3  1  0.75000000  0.00000000  0.25000000  1
  Li  Li4  1  0.00000100  0.16756200  0.50000000  1
  Li  Li5  1  0.25000000  0.66756200  0.75000000  1
  Li  Li6  1  0.50000000  0.16756200  0.00000000  1
  Li  Li7  1  0.75000000  0.66756200  0.25000000  1
  Li  Li8  1  0.00000100  0.83243800  0.50000000  1
  Li  Li9  1  0.25000000  0.33243800  0.75000000  1
  Li  Li10  1  0.50000000  0.83243800  0.00000000  1
  Li  Li11  1  0.75000000  0.33243900  0.25000000  1
  Al  Al12  1  0.50000100  0.33328200  0.50000100  1
  Al  Al13  1  0.75000000  0.83328300  0.74999900  1
  Al  Al14  1  0.00000000  0.33328300  0.00000000  1
  Al  Al15  1  0.25000000  0.83328300  0.25000000  1
  Al  Al16  1  0.50000100  0.66671800  0.50000100  1
  Al  Al17  1  0.75000000  0.16671800  0.74999900  1
  Al  Al18  1  0.00000000  0.66671800  0.00000000  1
  Al  Al19  1  0.25000000  0.16671800  0.25000000  1
  Cr  Cr20  1  0.50000700  0.99999900  0.50000000  1
  Cr  Cr21  1  0.74999400  0.49999000  0.75000300  1
  Cr  Cr22  1  0.99999300  0.99999900  0.99999100  1
  Cr  Cr23  1  0.24999800  0.49999900  0.25000400  1
  O  O24  1  0.39553400  0.50000000  0.61368800  1
  O  O25  1  0.64553400  0.00000000  0.86368900  1
  O  O26  1  0.89553400  0.50000000  0.11368900  1
  O  O27  1  0.14553400  0.00000000  0.36368800  1
  O  O28  1  0.60446700  0.50000000  0.38631100  1
  O  O29  1  0.85446700  0.00000000  0.63631200  1
  O  O30  1  0.10446700  0.50000000  0.88631200  1
  O  O31  1  0.35446700  0.00000000  0.13631100  1
  O  O32  1  0.84391400  0.67293000  0.62693300  1
  O  O33  1  0.09391200  0.17293100  0.87693500  1
  O  O34  1  0.34391300  0.67293100  0.12693300  1
  O  O35  1  0.59391100  0.17293100  0.37693400  1
  O  O36  1  0.84391400  0.32707000  0.62693300  1
  O  O37  1  0.09391200  0.82707000  0.87693400  1
  O  O38  1  0.34391300  0.32706900  0.12693400  1
  O  O39  1  0.59391100  0.82707000  0.37693300  1
  O  O40  1  0.15608800  0.67293000  0.37306500  1
  O  O41  1  0.40608600  0.17293000  0.62306700  1
  O  O42  1  0.65608900  0.67293100  0.87306600  1
  O  O43  1  0.90608700  0.17293100  0.12306700  1
  O  O44  1  0.15608800  0.32707000  0.37306500  1
  O  O45  1  0.40608600  0.82707000  0.62306700  1
  O  O46  1  0.65608900  0.32707000  0.87306600  1
  O  O47  1  0.90608800  0.82706900  0.12306700  1
