# generated using pymatgen
data_LiMnPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.24434500
_cell_length_b   9.48560400
_cell_length_c   10.20354913
_cell_angle_alpha   61.64543464
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPCO7
_chemical_formula_sum   'Li4 Mn4 P4 C4 O28'
_cell_volume   531.86128174
_cell_formula_units_Z   4
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  0.46799800  0.26132200  0.49540000  1
  Li  Li1  1  0.03200200  0.26132200  0.99540000  1
  Li  Li2  1  0.53200200  0.73867800  0.50460000  1
  Li  Li3  1  0.96799800  0.73867800  0.00460000  1
  Mn  Mn4  1  0.74934800  0.32915300  0.68847000  1
  Mn  Mn5  1  0.75065200  0.32915300  0.18847000  1
  Mn  Mn6  1  0.25065200  0.67084700  0.31153000  1
  Mn  Mn7  1  0.24934800  0.67084700  0.81153000  1
  P  P8  1  0.25038900  0.42480700  0.67611300  1
  P  P9  1  0.24961100  0.42480700  0.17611300  1
  P  P10  1  0.74961100  0.57519300  0.32388700  1
  P  P11  1  0.75038900  0.57519300  0.82388700  1
  C  C12  1  0.74160500  0.04794000  0.37150100  1
  C  C13  1  0.75839500  0.04794000  0.87150100  1
  C  C14  1  0.25839500  0.95206000  0.62849900  1
  C  C15  1  0.24160500  0.95206000  0.12849900  1
  O  O16  1  0.74379200  0.10231700  0.72641400  1
  O  O17  1  0.75620800  0.10231700  0.22641400  1
  O  O18  1  0.26660100  0.09372900  0.53320700  1
  O  O19  1  0.73506400  0.17037400  0.40135500  1
  O  O20  1  0.23339900  0.09372900  0.03320700  1
  O  O21  1  0.76493600  0.17037400  0.90135500  1
  O  O22  1  0.05374800  0.32448900  0.68128800  1
  O  O23  1  0.44050700  0.31233200  0.68931600  1
  O  O24  1  0.05949300  0.31233200  0.18931600  1
  O  O25  1  0.44625200  0.32448900  0.18128800  1
  O  O26  1  0.72775100  0.41478700  0.46930000  1
  O  O27  1  0.25996600  0.46304900  0.30896900  1
  O  O28  1  0.77224900  0.41478700  0.96930000  1
  O  O29  1  0.24003400  0.46304900  0.80896900  1
  O  O30  1  0.74003400  0.53695100  0.69103100  1
  O  O31  1  0.27224900  0.58521300  0.53070000  1
  O  O32  1  0.75996600  0.53695100  0.19103100  1
  O  O33  1  0.22775100  0.58521300  0.03070000  1
  O  O34  1  0.94625200  0.67551100  0.31871200  1
  O  O35  1  0.55949300  0.68766800  0.31068400  1
  O  O36  1  0.55374800  0.67551100  0.81871200  1
  O  O37  1  0.94050700  0.68766800  0.81068400  1
  O  O38  1  0.26493600  0.82962600  0.59864500  1
  O  O39  1  0.73339900  0.90627100  0.46679300  1
  O  O40  1  0.23506400  0.82962600  0.09864500  1
  O  O41  1  0.76660100  0.90627100  0.96679300  1
  O  O42  1  0.25620800  0.89768300  0.27358600  1
  O  O43  1  0.24379200  0.89768300  0.77358600  1
