# generated using pymatgen
data_Li6V3Cu(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.45956331
_cell_length_b   8.50528486
_cell_length_c   8.62561834
_cell_angle_alpha   61.74335670
_cell_angle_beta   62.52707666
_cell_angle_gamma   62.89876039
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6V3Cu(PO4)6
_chemical_formula_sum   'Li6 V3 Cu1 P6 O24'
_cell_volume   462.14528722
_cell_formula_units_Z   1
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  0.01455483  0.98954535  0.99068755  1
  Li  Li1  1  0.74393056  0.14603115  0.35257584  1
  Li  Li2  1  0.47997862  0.50926154  0.49870131  1
  Li  Li3  1  0.21881086  0.85186795  0.65616585  1
  Li  Li4  1  0.66032517  0.21012364  0.85254060  1
  Li  Li5  1  0.84793702  0.66869257  0.20247287  1
  V  V6  1  0.14122314  0.14718226  0.13417827  1
  V  V7  1  0.35949616  0.36062204  0.35897307  1
  V  V8  1  0.64336177  0.64581025  0.64439570  1
  Cu  Cu9  1  0.85397524  0.85311025  0.83600319  1
  P  P10  1  0.05891964  0.75156687  0.44624153  1
  P  P11  1  0.44845484  0.05340166  0.75698230  1
  P  P12  1  0.75249946  0.45729263  0.04669298  1
  P  P13  1  0.25439303  0.54221139  0.95935696  1
  P  P14  1  0.54190559  0.96404462  0.25682742  1
  P  P15  1  0.95215421  0.25035482  0.53592706  1
  O  O16  1  0.11718794  0.30832365  0.49069186  1
  O  O17  1  0.33173584  0.48879006  0.11029051  1
  O  O18  1  0.05417157  0.92316153  0.26026091  1
  O  O19  1  0.51777398  0.11160487  0.32794865  1
  O  O20  1  0.24783306  0.59793519  0.41088805  1
  O  O21  1  0.05001982  0.80418888  0.59654272  1
  O  O22  1  0.25391681  0.07176491  0.91292399  1
  O  O23  1  0.44084159  0.23956237  0.59002262  1
  O  O24  1  0.60565243  0.42243669  0.24304056  1
  O  O25  1  0.18246444  0.38304391  0.99984768  1
  O  O26  1  0.09818524  0.73278160  0.94705696  1
  O  O27  1  0.37012158  0.01830602  0.19873832  1
  O  O28  1  0.60010335  0.02863545  0.82465442  1
  O  O29  1  0.91097872  0.26189147  0.06670142  1
  O  O30  1  0.81138471  0.61704648  0.01869232  1
  O  O31  1  0.40665949  0.56089134  0.76398436  1
  O  O32  1  0.55294261  0.76738959  0.41175860  1
  O  O33  1  0.72989710  0.95003012  0.10003855  1
  O  O34  1  0.97208781  0.19626081  0.37721711  1
  O  O35  1  0.75997798  0.40675006  0.56538131  1
  O  O36  1  0.48742170  0.88797238  0.70183755  1
  O  O37  1  0.94275336  0.08399713  0.72465782  1
  O  O38  1  0.69611469  0.48956240  0.88688079  1
  O  O39  1  0.88785204  0.69555410  0.49221941  1
