# generated using pymatgen
data_Li2V2Cu(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.65761080
_cell_length_b   8.69565915
_cell_length_c   8.69565932
_cell_angle_alpha   60.99339550
_cell_angle_beta   61.33796156
_cell_angle_gamma   61.33796338
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2V2Cu(PO4)3
_chemical_formula_sum   'Li4 V4 Cu2 P6 O24'
_cell_volume   475.62361098
_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  0.75000000  0.14999717  0.35000283  1
  Li  Li1  1  0.25000000  0.84470816  0.65529184  1
  Li  Li2  1  0.65575646  0.24823277  0.84653653  1
  Li  Li3  1  0.84424354  0.65346347  0.25176723  1
  V  V4  1  0.14359793  0.14280431  0.13991315  1
  V  V5  1  0.35640207  0.36008685  0.35719569  1
  V  V6  1  0.64748322  0.64297184  0.64868195  1
  V  V7  1  0.85251678  0.85131805  0.85702816  1
  Cu  Cu8  1  0.02989478  0.99945179  0.97984538  1
  Cu  Cu9  1  0.47010522  0.52015462  0.50054821  1
  P  P10  1  0.04832368  0.74910326  0.45432860  1
  P  P11  1  0.45167632  0.04567140  0.75089674  1
  P  P12  1  0.75000000  0.45280139  0.04719861  1
  P  P13  1  0.25000000  0.53968226  0.96031774  1
  P  P14  1  0.54503243  0.96211129  0.25257259  1
  P  P15  1  0.95496757  0.24742741  0.53788871  1
  O  O16  1  0.12355834  0.29049412  0.49615283  1
  O  O17  1  0.30881743  0.50604805  0.11573159  1
  O  O18  1  0.04946567  0.91975532  0.27292021  1
  O  O19  1  0.53160550  0.11759712  0.30051249  1
  O  O20  1  0.01941484  0.79962996  0.61550084  1
  O  O21  1  0.23704986  0.58966600  0.43035743  1
  O  O22  1  0.26295014  0.06964257  0.91033400  1
  O  O23  1  0.45053433  0.22707979  0.58024468  1
  O  O24  1  0.19118257  0.38426841  0.99395195  1
  O  O25  1  0.59399937  0.42976449  0.23850162  1
  O  O26  1  0.08934506  0.73276366  0.93567246  1
  O  O27  1  0.37644166  0.00384717  0.20950588  1
  O  O28  1  0.61093447  0.01005052  0.81122182  1
  O  O29  1  0.90600063  0.26149838  0.07023551  1
  O  O30  1  0.41065494  0.56432754  0.76723634  1
  O  O31  1  0.80716392  0.61169301  0.01504607  1
  O  O32  1  0.56695367  0.76907896  0.41574850  1
  O  O33  1  0.73396434  0.92946428  0.09162567  1
  O  O34  1  0.76603566  0.40837433  0.57053572  1
  O  O35  1  0.96839450  0.19948751  0.38240288  1
  O  O36  1  0.48058516  0.88449916  0.70037004  1
  O  O37  1  0.93304633  0.08425150  0.73092104  1
  O  O38  1  0.69283608  0.48495393  0.88830699  1
  O  O39  1  0.88906553  0.68877818  0.48994948  1
