# generated using pymatgen
data_Li6MnV3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62615458
_cell_length_b   8.62615458
_cell_length_c   12.74538887
_cell_angle_alpha   74.02353524
_cell_angle_beta   74.02353524
_cell_angle_gamma   94.31574168
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6MnV3(PO4)6
_chemical_formula_sum   'Li12 Mn2 V6 P12 O48'
_cell_volume   864.76342203
_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  0.99433300  0.00635800  0.74814300  1
  Li  Li1  1  0.99364200  0.00566700  0.25185700  1
  Li  Li2  1  0.71378300  0.28621700  0.50000000  1
  Li  Li3  1  0.50023500  0.50175900  0.62358300  1
  Li  Li4  1  0.71200100  0.28799900  0.00000000  1
  Li  Li5  1  0.49824100  0.49976500  0.37641700  1
  Li  Li6  1  0.28889100  0.71389200  0.74841800  1
  Li  Li7  1  0.49973600  0.49991500  0.12515400  1
  Li  Li8  1  0.50008500  0.50026400  0.87484600  1
  Li  Li9  1  0.28610800  0.71110900  0.25158200  1
  Li  Li10  1  0.00610300  0.99389700  0.50000000  1
  Li  Li11  1  0.00682500  0.99317500  0.00000000  1
  Mn  Mn12  1  0.62452900  0.94224700  0.44181000  1
  Mn  Mn13  1  0.05775300  0.37547100  0.55819000  1
  V  V14  1  0.94260000  0.62170600  0.69474900  1
  V  V15  1  0.94264200  0.62008300  0.19645300  1
  V  V16  1  0.37991700  0.05735800  0.80354700  1
  V  V17  1  0.61956900  0.94276000  0.94515600  1
  V  V18  1  0.37829400  0.05740000  0.30525100  1
  V  V19  1  0.05724000  0.38043100  0.05484400  1
  P  P20  1  0.71543200  0.28712900  0.74987500  1
  P  P21  1  0.86490700  0.66329900  0.44285400  1
  P  P22  1  0.66078400  0.86254600  0.69257200  1
  P  P23  1  0.71287100  0.28456800  0.25012500  1
  P  P24  1  0.86244300  0.66133700  0.94319300  1
  P  P25  1  0.66065200  0.86176300  0.19344700  1
  P  P26  1  0.33670100  0.13509300  0.55714600  1
  P  P27  1  0.13823700  0.33934800  0.80655300  1
  P  P28  1  0.28534700  0.71465300  0.50000000  1
  P  P29  1  0.33866300  0.13755700  0.05680700  1
  P  P30  1  0.13745400  0.33921600  0.30742800  1
  P  P31  1  0.28545700  0.71454300  0.00000000  1
  O  O32  1  0.98778500  0.65970200  0.82972600  1
  O  O33  1  0.94732300  0.60708500  0.53946900  1
  O  O34  1  0.74332200  0.17105700  0.85779200  1
  O  O35  1  0.98976000  0.65547800  0.32988700  1
  O  O36  1  0.82964300  0.26168700  0.63899800  1
  O  O37  1  0.84340700  0.84197200  0.68037600  1
  O  O38  1  0.73660400  0.46212400  0.75999800  1
  O  O39  1  0.85253600  0.84872700  0.42339300  1
  O  O40  1  0.94975500  0.60166900  0.03812500  1
  O  O41  1  0.73831300  0.17035700  0.36100200  1
  O  O42  1  0.82894300  0.25667800  0.14220800  1
  O  O43  1  0.84396800  0.84197400  0.17954400  1
  O  O44  1  0.70552300  0.54771600  0.47588200  1
  O  O45  1  0.60028500  0.95009200  0.78765300  1
  O  O46  1  0.66325200  0.98797400  0.57726200  1
  O  O47  1  0.53973600  0.26260900  0.74105300  1
  O  O48  1  0.73739100  0.46026400  0.25894700  1
  O  O49  1  0.54324000  0.70409300  0.72703600  1
  O  O50  1  0.84202100  0.84477100  0.92880600  1
  O  O51  1  0.70383600  0.54392700  0.97724900  1
  O  O52  1  0.59897800  0.95027400  0.28820100  1
  O  O53  1  0.45228400  0.29447700  0.52411800  1
  O  O54  1  0.66042500  0.98771900  0.07945400  1
  O  O55  1  0.53787600  0.26339600  0.24000200  1
  O  O56  1  0.46210700  0.73803100  0.50926500  1
  O  O57  1  0.34452200  0.01024000  0.67011300  1
  O  O58  1  0.54433300  0.70342200  0.22650700  1
  O  O59  1  0.39291500  0.05267700  0.46053100  1
  O  O60  1  0.29657800  0.45566700  0.77349300  1
  O  O61  1  0.15802600  0.15603200  0.82045600  1
  O  O62  1  0.45607300  0.29616400  0.02275100  1
  O  O63  1  0.26196900  0.53789300  0.49073500  1
  O  O64  1  0.46166100  0.73713100  0.00900300  1
  O  O65  1  0.34029800  0.01221500  0.17027400  1
  O  O66  1  0.39833100  0.05024500  0.96187500  1
  O  O67  1  0.29590700  0.45676000  0.27296400  1
  O  O68  1  0.15127300  0.14746400  0.57660700  1
  O  O69  1  0.17172600  0.74289400  0.60862800  1
  O  O70  1  0.25710600  0.82827400  0.39137200  1
  O  O71  1  0.04972600  0.40102200  0.71179900  1
  O  O72  1  0.15802800  0.15659300  0.31962400  1
  O  O73  1  0.26286900  0.53833900  0.99099700  1
  O  O74  1  0.15522900  0.15797900  0.07119400  1
  O  O75  1  0.17095100  0.74152100  0.10852000  1
  O  O76  1  0.01202600  0.33674800  0.42273800  1
  O  O77  1  0.25847900  0.82904900  0.89148000  1
  O  O78  1  0.04990800  0.39971500  0.21234700  1
  O  O79  1  0.01228100  0.33957500  0.92054600  1
