# generated using pymatgen
data_Li4MnV3(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29021000
_cell_length_b   4.85730600
_cell_length_c   26.66624802
_cell_angle_alpha   88.53806271
_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   1073.44926141
_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  0.36123100  0.40986800  0.95646100  1
  Li  Li1  1  0.35983000  0.41363400  0.45666200  1
  Li  Li2  1  0.86123100  0.59013200  0.04353900  1
  Li  Li3  1  0.85983000  0.58636600  0.54333800  1
  Li  Li4  1  0.36157300  0.91010900  0.70620800  1
  Li  Li5  1  0.36119700  0.91006000  0.20663600  1
  Li  Li6  1  0.86119700  0.08994000  0.79336400  1
  Li  Li7  1  0.86157300  0.08989100  0.29379200  1
  Mn  Mn8  1  0.99724300  0.40058400  0.44272100  1
  Mn  Mn9  1  0.49724300  0.59941600  0.55727900  1
  V  V10  1  0.99957500  0.39841400  0.94285900  1
  V  V11  1  0.49957500  0.60158600  0.05714100  1
  V  V12  1  0.00073100  0.89931700  0.69255700  1
  V  V13  1  0.99978000  0.89833800  0.19299700  1
  V  V14  1  0.49978000  0.10166200  0.80700300  1
  V  V15  1  0.50073100  0.10068300  0.30744300  1
  P  P16  1  0.18016500  0.38919500  0.75550400  1
  P  P17  1  0.78675900  0.41853200  0.64655300  1
  P  P18  1  0.18104800  0.38850100  0.25586700  1
  P  P19  1  0.78427300  0.42007900  0.14652700  1
  P  P20  1  0.28427300  0.57992100  0.85347300  1
  P  P21  1  0.68104800  0.61149900  0.74413300  1
  P  P22  1  0.28675900  0.58146800  0.35344700  1
  P  P23  1  0.68016500  0.61080500  0.24449600  1
  P  P24  1  0.18028400  0.88856100  0.00559600  1
  P  P25  1  0.78412000  0.92000000  0.89645300  1
  P  P26  1  0.17649300  0.89134000  0.50388000  1
  P  P27  1  0.78525100  0.91902300  0.39737400  1
  P  P28  1  0.28412000  0.08000000  0.10354700  1
  P  P29  1  0.68028400  0.11143900  0.99440400  1
  P  P30  1  0.28525100  0.08097700  0.60262600  1
  P  P31  1  0.67649300  0.10866000  0.49612000  1
  O  O32  1  0.84340100  0.25627100  0.99854400  1
  O  O33  1  0.53808100  0.30492100  0.00443600  1
  O  O34  1  0.67739400  0.34355200  0.77628400  1
  O  O35  1  0.83958000  0.24781300  0.50179500  1
  O  O36  1  0.53255400  0.30198800  0.50451300  1
  O  O37  1  0.43407300  0.39332800  0.85396100  1
  O  O38  1  0.67773800  0.34279600  0.27614100  1
  O  O39  1  0.32414500  0.37551100  0.08760500  1
  O  O40  1  0.15341200  0.46832600  0.81334700  1
  O  O41  1  0.43624200  0.39390800  0.35306500  1
  O  O42  1  0.69697400  0.44032600  0.09631200  1
  O  O43  1  0.32640700  0.38087600  0.58854800  1
  O  O44  1  0.65434300  0.53085800  0.68658400  1
  O  O45  1  0.15434300  0.46914200  0.31341600  1
  O  O46  1  0.70305300  0.43337100  0.59631000  1
  O  O47  1  0.19697400  0.55967400  0.90368800  1
  O  O48  1  0.93624200  0.60609200  0.64693500  1
  O  O49  1  0.65341200  0.53167400  0.18665300  1
  O  O50  1  0.82414500  0.62448900  0.91239500  1
  O  O51  1  0.20305300  0.56662900  0.40369000  1
  O  O52  1  0.17773800  0.65720400  0.72385900  1
  O  O53  1  0.93407300  0.60667200  0.14603900  1
  O  O54  1  0.82640700  0.61912400  0.41145200  1
  O  O55  1  0.17739400  0.65644800  0.22371600  1
  O  O56  1  0.03808100  0.69507900  0.99556400  1
  O  O57  1  0.84397100  0.75598500  0.74841100  1
  O  O58  1  0.34340100  0.74372900  0.00145600  1
  O  O59  1  0.03255400  0.69801200  0.49548700  1
  O  O60  1  0.53852400  0.80482900  0.75440300  1
  O  O61  1  0.84379000  0.75609600  0.24845200  1
  O  O62  1  0.33958000  0.75218700  0.49820500  1
  O  O63  1  0.53878300  0.80483800  0.25443400  1
  O  O64  1  0.67747300  0.84335000  0.02623100  1
  O  O65  1  0.32453200  0.87554700  0.83766500  1
  O  O66  1  0.43411600  0.89358800  0.10392300  1
  O  O67  1  0.67050000  0.83779200  0.52765200  1
  O  O68  1  0.69682400  0.94052200  0.84634100  1
  O  O69  1  0.32633000  0.87603300  0.33634200  1
  O  O70  1  0.15324700  0.96806200  0.06331800  1
  O  O71  1  0.43472700  0.89403500  0.60367400  1
  O  O72  1  0.69658900  0.93764000  0.34712300  1
  O  O73  1  0.19658900  0.06236000  0.65287700  1
  O  O74  1  0.65324700  0.03193800  0.93668200  1
  O  O75  1  0.15482000  0.97224500  0.56224900  1
  O  O76  1  0.82633000  0.12396700  0.66365800  1
  O  O77  1  0.19682400  0.05947800  0.15365900  1
  O  O78  1  0.93411600  0.10641200  0.89607700  1
  O  O79  1  0.65482000  0.02775500  0.43775100  1
  O  O80  1  0.82453200  0.12445300  0.16233500  1
  O  O81  1  0.17747300  0.15665000  0.97376900  1
  O  O82  1  0.93472700  0.10596500  0.39632600  1
  O  O83  1  0.03878300  0.19516200  0.74556600  1
  O  O84  1  0.34379000  0.24390400  0.75154800  1
  O  O85  1  0.17050000  0.16220800  0.47234800  1
  O  O86  1  0.03852400  0.19517100  0.24559700  1
  O  O87  1  0.34397100  0.24401500  0.25158900  1
