# generated using pymatgen
data_Li3Mn4(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66630375
_cell_length_b   9.71107247
_cell_length_c   11.31543472
_cell_angle_alpha   89.97043906
_cell_angle_beta   101.42595881
_cell_angle_gamma   89.58194918
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn4(P2O7)4
_chemical_formula_sum   'Li6 Mn8 P16 O56'
_cell_volume   1041.10122619
_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  0.14623400  0.39899000  0.04512000  1
  Li  Li1  1  0.41369400  0.59147300  0.97729000  1
  Li  Li2  1  0.39957300  0.96309900  0.50040400  1
  Li  Li3  1  0.91231500  0.90844100  0.98336700  1
  Li  Li4  1  0.83035000  0.58915700  0.45615400  1
  Li  Li5  1  0.89263200  0.28291300  0.54684300  1
  Mn  Mn6  1  0.20280200  0.93303100  0.67415400  1
  Mn  Mn7  1  0.27558100  0.22294300  0.83261600  1
  Mn  Mn8  1  0.21298100  0.72418300  0.16575100  1
  Mn  Mn9  1  0.30556700  0.43350100  0.34117200  1
  Mn  Mn10  1  0.70081400  0.57800400  0.67553000  1
  Mn  Mn11  1  0.75367400  0.28588500  0.82634600  1
  Mn  Mn12  1  0.71882200  0.77140600  0.16437100  1
  Mn  Mn13  1  0.80801600  0.06960400  0.33342000  1
  P  P14  1  0.02105800  0.44322800  0.75881600  1
  P  P15  1  0.11439500  0.70899800  0.88688400  1
  P  P16  1  0.06829400  0.93032600  0.24683800  1
  P  P17  1  0.13632600  0.15930900  0.42117100  1
  P  P18  1  0.37509200  0.65464100  0.58152900  1
  P  P19  1  0.42361000  0.42349700  0.75422600  1
  P  P20  1  0.52383100  0.05126200  0.74664500  1
  P  P21  1  0.38583100  0.20526200  0.11136800  1
  P  P22  1  0.61535500  0.78550300  0.88448500  1
  P  P23  1  0.46693400  0.93391200  0.23864300  1
  P  P24  1  0.56520700  0.56833900  0.24458700  1
  P  P25  1  0.62841100  0.34605300  0.41934200  1
  P  P26  1  0.88061700  0.85930400  0.57214300  1
  P  P27  1  0.93176900  0.07345100  0.75945200  1
  P  P28  1  0.87725400  0.28661200  0.11716700  1
  P  P29  1  0.96936400  0.55551700  0.24385000  1
  O  O30  1  0.02187400  0.41150900  0.63043900  1
  O  O31  1  0.04084900  0.85691100  0.57251200  1
  O  O32  1  0.08518000  0.08120600  0.73396100  1
  O  O33  1  0.10544100  0.34720600  0.85694800  1
  O  O34  1  0.09109500  0.59138600  0.78497000  1
  O  O35  1  0.19324400  0.82127800  0.83415700  1
  O  O36  1  0.20941200  0.63922000  0.00187700  1
  O  O37  1  0.02251300  0.26370800  0.08941800  1
  O  O38  1  0.13049600  0.07553500  0.29407000  1
  O  O39  1  0.07206200  0.91272300  0.11439200  1
  O  O40  1  0.12140700  0.54261900  0.20976200  1
  O  O41  1  0.18259200  0.30436700  0.39169800  1
  O  O42  1  0.16884100  0.81330100  0.30901200  1
  O  O43  1  0.23121300  0.07562100  0.51767300  1
  O  O44  1  0.29037500  0.58419200  0.47300000  1
  O  O45  1  0.32710700  0.30583300  0.69176800  1
  O  O46  1  0.33139400  0.80329800  0.60627900  1
  O  O47  1  0.36874900  0.04205300  0.77616500  1
  O  O48  1  0.35974400  0.56792400  0.70104600  1
  O  O49  1  0.40391800  0.41536600  0.88498400  1
  O  O50  1  0.47315400  0.74983500  0.90785000  1
  O  O51  1  0.29279900  0.14993300  0.99336300  1
  O  O52  1  0.31291600  0.32579700  0.16298600  1
  O  O53  1  0.39751900  0.08553900  0.20961000  1
  O  O54  1  0.41466600  0.57432400  0.27406800  1
  O  O55  1  0.37648400  0.83412100  0.14966100  1
  O  O56  1  0.52654200  0.06656400  0.61678400  1
  O  O57  1  0.47457200  0.33718300  0.43097500  1
  O  O58  1  0.53501600  0.65340800  0.57740300  1
  O  O59  1  0.47021700  0.90907400  0.36826200  1
  O  O60  1  0.60181300  0.15973500  0.83521500  1
  O  O61  1  0.57638800  0.41581600  0.73459900  1
  O  O62  1  0.60215100  0.90899000  0.78972500  1
  O  O63  1  0.69177400  0.67275100  0.82532800  1
  O  O64  1  0.71907300  0.83782400  0.00028700  1
  O  O65  1  0.53172300  0.24025800  0.09043700  1
  O  O66  1  0.56700300  0.58712900  0.11245200  1
  O  O67  1  0.63014300  0.42186700  0.29131700  1
  O  O68  1  0.61681200  0.93862100  0.20453600  1
  O  O69  1  0.69828700  0.20661900  0.40778300  1
  O  O70  1  0.67181200  0.67712700  0.31022800  1
  O  O71  1  0.72201700  0.43386900  0.51772800  1
  O  O72  1  0.79565900  0.93778600  0.46417100  1
  O  O73  1  0.84054100  0.19699800  0.69735100  1
  O  O74  1  0.82521200  0.71486600  0.58595500  1
  O  O75  1  0.86351700  0.45630500  0.78482600  1
  O  O76  1  0.91673100  0.06993700  0.88854000  1
  O  O77  1  0.86245800  0.93768700  0.69367700  1
  O  O78  1  0.97293600  0.75094500  0.91068000  1
  O  O79  1  0.77779600  0.33254800  0.99926400  1
  O  O80  1  0.81744800  0.16915700  0.18191000  1
  O  O81  1  0.88946900  0.41167600  0.21163400  1
  O  O82  1  0.88657700  0.66139700  0.15444300  1
  O  O83  1  0.91696400  0.92206300  0.27385500  1
  O  O84  1  0.98340700  0.17009100  0.43829100  1
  O  O85  1  0.97537700  0.57944300  0.37429500  1
