# generated using pymatgen
data_LiMnPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.84380783
_cell_length_b   10.84380783
_cell_length_c   12.68398800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999893
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPO4
_chemical_formula_sum   'Li12 Mn12 P12 O48'
_cell_volume   1291.66557062
_cell_formula_units_Z   12
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  0.00000000  0.50000000  0.00607200  1
  Li  Li1  1  0.00000000  0.50000000  0.66059500  1
  Li  Li2  1  0.00000000  0.50000000  0.33333300  1
  Li  Li3  1  0.00000000  0.00000000  0.16666700  1
  Li  Li4  1  0.00000000  0.00000000  0.50000000  1
  Li  Li5  1  0.00000000  0.00000000  0.83333300  1
  Li  Li6  1  0.50000000  0.50000000  0.33940500  1
  Li  Li7  1  0.50000000  0.50000000  0.66666700  1
  Li  Li8  1  0.50000000  0.50000000  0.99392800  1
  Li  Li9  1  0.50000000  0.00000000  0.32726100  1
  Li  Li10  1  0.50000000  0.00000000  0.00000000  1
  Li  Li11  1  0.50000000  0.00000000  0.67273900  1
  Mn  Mn12  1  0.00000000  0.74903700  0.83333300  1
  Mn  Mn13  1  0.00000000  0.25096300  0.83333300  1
  Mn  Mn14  1  0.24882000  0.75118000  0.16666700  1
  Mn  Mn15  1  0.24882000  0.49763900  0.50000000  1
  Mn  Mn16  1  0.50236100  0.75118000  0.83333300  1
  Mn  Mn17  1  0.25096300  0.25096300  0.16666700  1
  Mn  Mn18  1  0.25096300  0.00000000  0.50000000  1
  Mn  Mn19  1  0.74903700  0.74903700  0.16666700  1
  Mn  Mn20  1  0.49763900  0.24882000  0.83333300  1
  Mn  Mn21  1  0.75118000  0.50236100  0.50000000  1
  Mn  Mn22  1  0.75118000  0.24882000  0.16666700  1
  Mn  Mn23  1  0.74903700  0.00000000  0.50000000  1
  P  P24  1  0.00000000  0.75625900  0.33333300  1
  P  P25  1  0.24763500  0.75236500  0.66666700  1
  P  P26  1  0.00000000  0.24374100  0.33333300  1
  P  P27  1  0.24763500  0.49527000  0.00000000  1
  P  P28  1  0.24374100  0.24374100  0.66666700  1
  P  P29  1  0.50473000  0.75236500  0.33333300  1
  P  P30  1  0.24374100  0.00000000  0.00000000  1
  P  P31  1  0.49527000  0.24763500  0.33333300  1
  P  P32  1  0.75625900  0.75625900  0.66666700  1
  P  P33  1  0.75236500  0.50473000  0.00000000  1
  P  P34  1  0.75236500  0.24763500  0.66666700  1
  P  P35  1  0.75625900  0.00000000  0.00000000  1
  O  O36  1  0.06405500  0.87388000  0.41988100  1
  O  O37  1  0.12612000  0.93594500  0.91345200  1
  O  O38  1  0.10570200  0.69911800  0.72825900  1
  O  O39  1  0.10932700  0.71912500  0.28403900  1
  O  O40  1  0.28087500  0.89067300  0.04929500  1
  O  O41  1  0.30088200  0.89429800  0.60507400  1
  O  O42  1  0.20562500  0.62415600  0.59179600  1
  O  O43  1  0.10570200  0.40658300  0.93840800  1
  O  O44  1  0.20562500  0.58146900  0.07487100  1
  O  O45  1  0.10932700  0.39020200  0.38262800  1
  O  O46  1  0.06405500  0.19017600  0.24678500  1
  O  O47  1  0.37584400  0.79437500  0.74153800  1
  O  O48  1  0.41853100  0.79437500  0.25846200  1
  O  O49  1  0.12612000  0.19017600  0.75321500  1
  O  O50  1  0.28087500  0.39020200  0.61737200  1
  O  O51  1  0.37584400  0.58146900  0.92512900  1
  O  O52  1  0.30088200  0.40658300  0.06159200  1
  O  O53  1  0.41853100  0.62415600  0.40820400  1
  O  O54  1  0.19017600  0.12612000  0.58011900  1
  O  O55  1  0.19017600  0.06405500  0.08654800  1
  O  O56  1  0.59341700  0.89429800  0.39492600  1
  O  O57  1  0.60979800  0.89067300  0.95070500  1
  O  O58  1  0.60979800  0.71912500  0.71596100  1
  O  O59  1  0.40658300  0.30088200  0.27174100  1
  O  O60  1  0.59341700  0.69911800  0.27174100  1
  O  O61  1  0.39020200  0.28087500  0.71596100  1
  O  O62  1  0.39020200  0.10932700  0.95070500  1
  O  O63  1  0.40658300  0.10570200  0.39492600  1
  O  O64  1  0.80982400  0.93594500  0.08654800  1
  O  O65  1  0.80982400  0.87388000  0.58011900  1
  O  O66  1  0.58146900  0.37584400  0.40820400  1
  O  O67  1  0.69911800  0.59341700  0.06159200  1
  O  O68  1  0.62415600  0.41853100  0.92512900  1
  O  O69  1  0.71912500  0.60979800  0.61737200  1
  O  O70  1  0.87388000  0.80982400  0.75321500  1
  O  O71  1  0.58146900  0.20562500  0.25846200  1
  O  O72  1  0.62415600  0.20562500  0.74153800  1
  O  O73  1  0.93594500  0.80982400  0.24678500  1
  O  O74  1  0.89067300  0.60979800  0.38262800  1
  O  O75  1  0.79437500  0.41853100  0.07487100  1
  O  O76  1  0.89429800  0.59341700  0.93840800  1
  O  O77  1  0.79437500  0.37584400  0.59179600  1
  O  O78  1  0.69911800  0.10570200  0.60507400  1
  O  O79  1  0.71912500  0.10932700  0.04929500  1
  O  O80  1  0.89067300  0.28087500  0.28403900  1
  O  O81  1  0.89429800  0.30088200  0.72825900  1
  O  O82  1  0.87388000  0.06405500  0.91345200  1
  O  O83  1  0.93594500  0.12612000  0.41988100  1
