# generated using pymatgen
data_Li6V3Cu(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.45956351
_cell_length_b   8.50528532
_cell_length_c   8.62561788
_cell_angle_alpha   61.74335475
_cell_angle_beta   62.52707523
_cell_angle_gamma   62.89876088
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6V3Cu(PO4)6
_chemical_formula_sum   'Li6 V3 Cu1 P6 O24'
_cell_volume   462.14528839
_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  0.01455500  0.98954500  0.99068800  1
  Li  Li1  1  0.74393100  0.14603100  0.35257600  1
  Li  Li2  1  0.47997900  0.50926200  0.49870100  1
  Li  Li3  1  0.21881100  0.85186800  0.65616600  1
  Li  Li4  1  0.66032500  0.21012400  0.85254100  1
  Li  Li5  1  0.84793700  0.66869300  0.20247300  1
  V  V6  1  0.14122300  0.14718200  0.13417800  1
  V  V7  1  0.35949600  0.36062200  0.35897300  1
  V  V8  1  0.64336200  0.64581000  0.64439600  1
  Cu  Cu9  1  0.85397500  0.85311000  0.83600300  1
  P  P10  1  0.05892000  0.75156700  0.44624200  1
  P  P11  1  0.44845500  0.05340200  0.75698200  1
  P  P12  1  0.75249900  0.45729300  0.04669300  1
  P  P13  1  0.25439300  0.54221100  0.95935700  1
  P  P14  1  0.54190600  0.96404500  0.25682700  1
  P  P15  1  0.95215400  0.25035500  0.53592700  1
  O  O16  1  0.11718800  0.30832400  0.49069200  1
  O  O17  1  0.33173600  0.48879000  0.11029100  1
  O  O18  1  0.05417200  0.92316200  0.26026100  1
  O  O19  1  0.51777400  0.11160500  0.32794900  1
  O  O20  1  0.24783300  0.59793500  0.41088800  1
  O  O21  1  0.05002000  0.80418900  0.59654300  1
  O  O22  1  0.25391700  0.07176500  0.91292400  1
  O  O23  1  0.44084200  0.23956200  0.59002300  1
  O  O24  1  0.60565200  0.42243700  0.24304100  1
  O  O25  1  0.18246400  0.38304400  0.99984800  1
  O  O26  1  0.09818500  0.73278200  0.94705700  1
  O  O27  1  0.37012200  0.01830600  0.19873800  1
  O  O28  1  0.60010300  0.02863500  0.82465400  1
  O  O29  1  0.91097900  0.26189100  0.06670100  1
  O  O30  1  0.81138500  0.61704600  0.01869200  1
  O  O31  1  0.40665900  0.56089100  0.76398400  1
  O  O32  1  0.55294300  0.76739000  0.41175900  1
  O  O33  1  0.72989700  0.95003000  0.10003900  1
  O  O34  1  0.97208800  0.19626100  0.37721700  1
  O  O35  1  0.75997800  0.40675000  0.56538100  1
  O  O36  1  0.48742200  0.88797200  0.70183800  1
  O  O37  1  0.94275300  0.08399700  0.72465800  1
  O  O38  1  0.69611500  0.48956200  0.88688100  1
  O  O39  1  0.88785200  0.69555400  0.49221900  1
