# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.73821000
_cell_length_b   9.74988279
_cell_length_c   11.12772628
_cell_angle_alpha   102.47443002
_cell_angle_beta   90.01865454
_cell_angle_gamma   90.79213863
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP2O7
_chemical_formula_sum   'Li8 Mn8 P16 O56'
_cell_volume   1031.49088559
_cell_formula_units_Z   8
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  0.57165800  0.16686800  0.53853700  1
  Li  Li1  1  0.39021500  0.40742200  0.97206900  1
  Li  Li2  1  0.06398900  0.36218600  0.47688500  1
  Li  Li3  1  0.60547200  0.58827300  0.02987500  1
  Li  Li4  1  0.90872100  0.64881100  0.04509000  1
  Li  Li5  1  0.09771600  0.91528800  0.97480500  1
  Li  Li6  1  0.41339200  0.82534500  0.45398900  1
  Li  Li7  1  0.71937800  0.88002400  0.54883600  1
  Mn  Mn8  1  0.07380800  0.19976900  0.67187800  1
  Mn  Mn9  1  0.78878800  0.25793200  0.82897000  1
  Mn  Mn10  1  0.27829400  0.22599200  0.16895800  1
  Mn  Mn11  1  0.57344500  0.30498900  0.32690700  1
  Mn  Mn12  1  0.42736300  0.70253300  0.67766100  1
  Mn  Mn13  1  0.72147000  0.76974000  0.83424900  1
  Mn  Mn14  1  0.21631100  0.73441900  0.16970700  1
  Mn  Mn15  1  0.93017100  0.80514800  0.33385100  1
  P  P16  1  0.55424300  0.02501300  0.75705900  1
  P  P17  1  0.28555000  0.11507700  0.88180100  1
  P  P18  1  0.07059800  0.06605900  0.24466400  1
  P  P19  1  0.85141700  0.12717300  0.43166700  1
  P  P20  1  0.35618200  0.38170100  0.57421700  1
  P  P21  1  0.57572800  0.43461100  0.75947500  1
  P  P22  1  0.94284900  0.52261200  0.74912300  1
  P  P23  1  0.79138400  0.37886300  0.11491300  1
  P  P24  1  0.20787900  0.61596500  0.88508500  1
  P  P25  1  0.06148400  0.46852100  0.24053900  1
  P  P26  1  0.42585100  0.56488300  0.24028700  1
  P  P27  1  0.65252100  0.62512500  0.41969600  1
  P  P28  1  0.14441600  0.87748900  0.57275500  1
  P  P29  1  0.92536600  0.92984900  0.75880300  1
  P  P30  1  0.71530800  0.88939600  0.11545500  1
  P  P31  1  0.44594100  0.97582000  0.24744100  1
  O  O32  1  0.58332300  0.01747500  0.62272400  1
  O  O33  1  0.15279900  0.03427600  0.56999500  1
  O  O34  1  0.91220800  0.07797800  0.73376300  1
  O  O35  1  0.65648000  0.11241600  0.84807000  1
  O  O36  1  0.40994700  0.09882700  0.78242200  1
  O  O37  1  0.17496300  0.18751700  0.81909200  1
  O  O38  1  0.34093100  0.22227100  0.99786400  1
  O  O39  1  0.74482100  0.02469300  0.08285800  1
  O  O40  1  0.92609700  0.12420800  0.30079300  1
  O  O41  1  0.08009400  0.06660100  0.11042500  1
  O  O42  1  0.45034900  0.12653500  0.21605200  1
  O  O43  1  0.71158000  0.18844900  0.41747100  1
  O  O44  1  0.18195300  0.17255000  0.31023300  1
  O  O45  1  0.94672500  0.21681900  0.52942200  1
  O  O46  1  0.44616300  0.29469600  0.47190300  1
  O  O47  1  0.68303400  0.32436000  0.69882200  1
  O  O48  1  0.21288200  0.32324100  0.58346200  1
  O  O49  1  0.95176400  0.37057100  0.78393000  1
  O  O50  1  0.43095500  0.36921400  0.70069400  1
  O  O51  1  0.56708800  0.43479200  0.89484900  1
  O  O52  1  0.23347600  0.47955300  0.91906000  1
  O  O53  1  0.84123000  0.27460100  0.99959100  1
  O  O54  1  0.66962700  0.31762000  0.17653400  1
  O  O55  1  0.91189800  0.39588000  0.21595900  1
  O  O56  1  0.40800500  0.42076400  0.27174800  1
  O  O57  1  0.15816500  0.37645700  0.14822500  1
  O  O58  1  0.91475000  0.51778400  0.61820000  1
  O  O59  1  0.66127100  0.47270100  0.42943800  1
  O  O60  1  0.35170900  0.53891400  0.57082600  1
  O  O61  1  0.09089100  0.48302500  0.37302000  1
  O  O62  1  0.84994600  0.61153400  0.85070400  1
  O  O63  1  0.59303300  0.58047600  0.72918900  1
  O  O64  1  0.09223100  0.59527300  0.77983500  1
  O  O65  1  0.32801200  0.68487000  0.82959400  1
  O  O66  1  0.14406600  0.72453500  0.99889600  1
  O  O67  1  0.76848600  0.52276100  0.08924300  1
  O  O68  1  0.42886700  0.56632700  0.10503500  1
  O  O69  1  0.57181800  0.62981600  0.29351600  1
  O  O70  1  0.05279200  0.61518300  0.19828200  1
  O  O71  1  0.79137900  0.69392600  0.40665700  1
  O  O72  1  0.31866000  0.67537900  0.30291100  1
  O  O73  1  0.56792800  0.72030100  0.52224300  1
  O  O74  1  0.06315700  0.79089800  0.46381800  1
  O  O75  1  0.80470100  0.83353800  0.69440200  1
  O  O76  1  0.28693000  0.82033300  0.58658000  1
  O  O77  1  0.54371900  0.87169500  0.78509800  1
  O  O78  1  0.92476000  0.91269700  0.89001800  1
  O  O79  1  0.06426800  0.86445600  0.69679700  1
  O  O80  1  0.25396200  0.97476500  0.90631800  1
  O  O81  1  0.66464100  0.77007600  0.00258000  1
  O  O82  1  0.83080700  0.81590800  0.17699400  1
  O  O83  1  0.59165200  0.90124100  0.21372500  1
  O  O84  1  0.34118000  0.88694100  0.15734100  1
  O  O85  1  0.08190000  0.91568100  0.27269000  1
  O  O86  1  0.83726000  0.97610800  0.44776800  1
  O  O87  1  0.42815100  0.98095700  0.38160800  1
