# generated using pymatgen
data_LiVCr(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.16441900
_cell_length_b   8.06506147
_cell_length_c   13.65595112
_cell_angle_alpha   89.88317318
_cell_angle_beta   82.78562330
_cell_angle_gamma   89.90338999
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCr(P2O7)2
_chemical_formula_sum   'Li3 V3 Cr3 P12 O42'
_cell_volume   782.81179874
_cell_formula_units_Z   3
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  0.15875900  0.86440500  0.16624500  1
  Li  Li1  1  0.82418000  0.86428800  0.50062700  1
  Li  Li2  1  0.83863700  0.36218300  0.83308900  1
  V  V3  1  0.11607200  0.49485500  0.16244200  1
  V  V4  1  0.78073300  0.49540700  0.49458300  1
  V  V5  1  0.44294900  0.50705700  0.82881400  1
  Cr  Cr6  1  0.55654400  0.00618500  0.16981900  1
  Cr  Cr7  1  0.22510700  0.00549700  0.50512000  1
  Cr  Cr8  1  0.88673900  0.99713200  0.83773800  1
  P  P9  1  0.86774700  0.78157700  0.04329700  1
  P  P10  1  0.47976900  0.67778700  0.04177000  1
  P  P11  1  0.79607000  0.28114000  0.28770400  1
  P  P12  1  0.18543900  0.17980800  0.29457700  1
  P  P13  1  0.53468100  0.78279700  0.37606100  1
  P  P14  1  0.14734000  0.67914500  0.37537200  1
  P  P15  1  0.85039500  0.18059200  0.62694100  1
  P  P16  1  0.46181300  0.28263800  0.62314100  1
  P  P17  1  0.81733300  0.68283900  0.70710100  1
  P  P18  1  0.20445200  0.78335400  0.70992100  1
  P  P19  1  0.52182100  0.17645500  0.95949700  1
  P  P20  1  0.13349400  0.28148100  0.95519700  1
  O  O21  1  0.69687500  0.64693100  0.05341500  1
  O  O22  1  0.81172600  0.93413900  0.10621800  1
  O  O23  1  0.53870800  0.18058800  0.06859100  1
  O  O24  1  0.42316700  0.84779500  0.08501700  1
  O  O25  1  0.37057600  0.53825000  0.09909900  1
  O  O26  1  0.86749900  0.43505100  0.22666100  1
  O  O27  1  0.08376400  0.33092000  0.06441800  1
  O  O28  1  0.96477800  0.14701100  0.28321200  1
  O  O29  1  0.02771600  0.68774000  0.08612300  1
  O  O30  1  0.63435300  0.18973300  0.25387500  1
  O  O31  1  0.58695200  0.82355500  0.26796900  1
  O  O32  1  0.28429100  0.04221200  0.23070300  1
  O  O33  1  0.23186100  0.35253100  0.24876400  1
  O  O34  1  0.13037000  0.67729400  0.26337400  1
  O  O35  1  0.74942000  0.33378500  0.39696400  1
  O  O36  1  0.69564600  0.68882700  0.41809700  1
  O  O37  1  0.36420000  0.64781600  0.38702000  1
  O  O38  1  0.47910400  0.93409500  0.44025700  1
  O  O39  1  0.20974300  0.17825400  0.40211200  1
  O  O40  1  0.95108600  0.04170300  0.56603500  1
  O  O41  1  0.89854500  0.35257700  0.58156700  1
  O  O42  1  0.09064300  0.84874700  0.41985300  1
  O  O43  1  0.03740300  0.53871700  0.43071600  1
  O  O44  1  0.79560800  0.67497400  0.59575800  1
  O  O45  1  0.53387200  0.43469000  0.56041200  1
  O  O46  1  0.63095200  0.14759700  0.61744000  1
  O  O47  1  0.30031800  0.19059100  0.58943500  1
  O  O48  1  0.25580900  0.82472200  0.60170300  1
  O  O49  1  0.87533500  0.18240300  0.73597800  1
  O  O50  1  0.76472000  0.85271100  0.74740600  1
  O  O51  1  0.71215700  0.54078300  0.76646100  1
  O  O52  1  0.41848800  0.33831400  0.73181400  1
  O  O53  1  0.36331900  0.68285100  0.74781300  1
  O  O54  1  0.96778700  0.19689400  0.91728400  1
  O  O55  1  0.03340900  0.64527500  0.71845600  1
  O  O56  1  0.92233000  0.81869600  0.93500300  1
  O  O57  1  0.14033400  0.93221100  0.77321400  1
  O  O58  1  0.62445200  0.03896500  0.90051000  1
  O  O59  1  0.57189700  0.34819400  0.91062600  1
  O  O60  1  0.46143900  0.66754800  0.93069900  1
  O  O61  1  0.19369200  0.43674600  0.89269100  1
  O  O62  1  0.29937200  0.14828500  0.94797000  1
