# generated using pymatgen
data_Li4MnV3(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.27904900
_cell_length_b   4.87265700
_cell_length_c   26.71461865
_cell_angle_alpha   88.70705684
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnV3(P2O7)4
_chemical_formula_sum   'Li8 Mn2 V6 P16 O56'
_cell_volume   1077.41913922
_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  0.36261600  0.16198100  0.08092100  1
  Li  Li1  1  0.36269300  0.16190300  0.58054200  1
  Li  Li2  1  0.86276800  0.33803000  0.16934500  1
  Li  Li3  1  0.86249400  0.33678200  0.66871600  1
  Li  Li4  1  0.36276800  0.66197000  0.83065500  1
  Li  Li5  1  0.36249400  0.66321800  0.33128400  1
  Li  Li6  1  0.86261600  0.83801900  0.91907900  1
  Li  Li7  1  0.86269300  0.83809700  0.41945800  1
  Mn  Mn8  1  0.99921200  0.14932100  0.56744600  1
  Mn  Mn9  1  0.49921200  0.85067900  0.43255400  1
  V  V10  1  0.99974100  0.14869100  0.06782900  1
  V  V11  1  0.49976000  0.35123400  0.18222100  1
  V  V12  1  0.49938800  0.35165400  0.68209100  1
  V  V13  1  0.99976000  0.64876600  0.81777900  1
  V  V14  1  0.99938800  0.64834600  0.31790900  1
  V  V15  1  0.49974100  0.85130900  0.93217100  1
  P  P16  1  0.18029200  0.13939300  0.88053100  1
  P  P17  1  0.78336700  0.16976700  0.77142200  1
  P  P18  1  0.18003600  0.13888600  0.37977000  1
  P  P19  1  0.78414600  0.16937600  0.27154200  1
  P  P20  1  0.28385600  0.33042000  0.97853000  1
  P  P21  1  0.68037300  0.36075300  0.86948800  1
  P  P22  1  0.28574900  0.33220300  0.47790800  1
  P  P23  1  0.67869500  0.35951600  0.36967500  1
  P  P24  1  0.18037300  0.63924700  0.13051200  1
  P  P25  1  0.78385600  0.66958000  0.02147000  1
  P  P26  1  0.17869500  0.64048400  0.63032500  1
  P  P27  1  0.78575000  0.66779700  0.52209200  1
  P  P28  1  0.28336700  0.83023300  0.22857800  1
  P  P29  1  0.68029200  0.86060700  0.11946900  1
  P  P30  1  0.28414600  0.83062400  0.72845800  1
  P  P31  1  0.68003600  0.86111400  0.62023000  1
  O  O32  1  0.84384900  0.00503300  0.12345100  1
  O  O33  1  0.53829500  0.05428000  0.12943500  1
  O  O34  1  0.67777000  0.09437400  0.90141200  1
  O  O35  1  0.84235500  0.00232700  0.62564700  1
  O  O36  1  0.53618100  0.05305500  0.62941500  1
  O  O37  1  0.43364500  0.14375000  0.97933800  1
  O  O38  1  0.67716800  0.09320100  0.40191600  1
  O  O39  1  0.32374900  0.12456300  0.21269600  1
  O  O40  1  0.15280100  0.21886500  0.93828900  1
  O  O41  1  0.43545400  0.14357600  0.47881100  1
  O  O42  1  0.69633700  0.18822000  0.22130100  1
  O  O43  1  0.32440600  0.12451300  0.71296400  1
  O  O44  1  0.65261200  0.28120200  0.81191200  1
  O  O45  1  0.15451300  0.21984900  0.43791500  1
  O  O46  1  0.69535900  0.18866800  0.72157000  1
  O  O47  1  0.19622000  0.31196600  0.02862800  1
  O  O48  1  0.93355000  0.35566200  0.77074500  1
  O  O49  1  0.65234400  0.28066800  0.31169600  1
  O  O50  1  0.82410200  0.37538600  0.03713500  1
  O  O51  1  0.20092200  0.31814600  0.52833200  1
  O  O52  1  0.17810600  0.40557500  0.84873900  1
  O  O53  1  0.93332600  0.35668200  0.27065000  1
  O  O54  1  0.82600600  0.36974000  0.53722200  1
  O  O55  1  0.17542200  0.40824000  0.34860600  1
  O  O56  1  0.03811500  0.44571100  0.12045700  1
  O  O57  1  0.84381300  0.50494700  0.87356700  1
  O  O58  1  0.34381300  0.49505300  0.12643300  1
  O  O59  1  0.03678000  0.44600300  0.62039700  1
  O  O60  1  0.53811500  0.55428900  0.87954300  1
  O  O61  1  0.84277100  0.50336700  0.37349800  1
  O  O62  1  0.34277100  0.49663300  0.62650200  1
  O  O63  1  0.53678000  0.55399700  0.37960300  1
  O  O64  1  0.67810600  0.59442500  0.15126100  1
  O  O65  1  0.32410200  0.62461400  0.96286500  1
  O  O66  1  0.43355000  0.64433800  0.22925500  1
  O  O67  1  0.67542200  0.59176000  0.65139400  1
  O  O68  1  0.69622000  0.68803400  0.97137200  1
  O  O69  1  0.32600600  0.63026000  0.46277800  1
  O  O70  1  0.15261200  0.71879800  0.18808800  1
  O  O71  1  0.43332600  0.64331800  0.72935000  1
  O  O72  1  0.70092200  0.68185400  0.47166800  1
  O  O73  1  0.19633700  0.81178000  0.77869900  1
  O  O74  1  0.65280100  0.78113500  0.06171100  1
  O  O75  1  0.15234400  0.71933200  0.68830400  1
  O  O76  1  0.82374900  0.87543700  0.78730400  1
  O  O77  1  0.19535900  0.81133200  0.27843000  1
  O  O78  1  0.93364500  0.85625000  0.02066200  1
  O  O79  1  0.65451300  0.78015100  0.56208500  1
  O  O80  1  0.82440600  0.87548700  0.28703600  1
  O  O81  1  0.17777000  0.90562600  0.09858800  1
  O  O82  1  0.93545400  0.85642400  0.52118900  1
  O  O83  1  0.03829500  0.94572000  0.87056500  1
  O  O84  1  0.34384900  0.99496700  0.87654900  1
  O  O85  1  0.17716800  0.90679900  0.59808400  1
  O  O86  1  0.03618100  0.94694500  0.37058500  1
  O  O87  1  0.34235500  0.99767300  0.37435300  1
