# generated using pymatgen data_Li4Ti4Mn4CrO18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.95595700 _cell_length_b 9.15131000 _cell_length_c 25.22172700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ti4Mn4CrO18 _chemical_formula_sum 'Li8 Ti8 Mn8 Cr2 O36' _cell_volume 682.26988156 _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 0.50000000 0.19103500 0.99702700 1.0 Li Li1 1 0.50000000 0.20528000 0.19468100 1.0 Li Li2 1 0.50000000 0.29472000 0.69468100 1.0 Li Li3 1 0.50000000 0.30896500 0.49702700 1.0 Li Li4 1 0.50000000 0.69103500 0.50297300 1.0 Li Li5 1 0.50000000 0.70528000 0.30531900 1.0 Li Li6 1 0.50000000 0.79472000 0.80531900 1.0 Li Li7 1 0.50000000 0.80896500 0.00297300 1.0 Ti Ti8 1 0.50000000 0.00347400 0.10297700 1.0 Ti Ti9 1 0.00000000 0.14575300 0.80506100 1.0 Ti Ti10 1 0.00000000 0.35424700 0.30506100 1.0 Ti Ti11 1 0.50000000 0.49652600 0.60297700 1.0 Ti Ti12 1 0.50000000 0.50347400 0.39702300 1.0 Ti Ti13 1 0.00000000 0.64575300 0.69493900 1.0 Ti Ti14 1 0.00000000 0.85424700 0.19493900 1.0 Ti Ti15 1 0.50000000 0.99652600 0.89702300 1.0 Mn Mn16 1 0.50000000 0.01855700 0.31367000 1.0 Mn Mn17 1 0.00000000 0.14382700 0.58629700 1.0 Mn Mn18 1 0.00000000 0.35617300 0.08629700 1.0 Mn Mn19 1 0.50000000 0.48144300 0.81367000 1.0 Mn Mn20 1 0.50000000 0.51855700 0.18633000 1.0 Mn Mn21 1 0.00000000 0.64382700 0.91370300 1.0 Mn Mn22 1 0.00000000 0.85617300 0.41370300 1.0 Mn Mn23 1 0.50000000 0.98144300 0.68633000 1.0 Cr Cr24 1 0.50000000 0.00000000 0.50000000 1.0 Cr Cr25 1 0.50000000 0.50000000 0.00000000 1.0 O O26 1 0.50000000 0.99538700 0.42077100 1.0 O O27 1 0.50000000 0.00461300 0.57922900 1.0 O O28 1 0.00000000 0.04199200 0.94163500 1.0 O O29 1 0.00000000 0.05272300 0.16009800 1.0 O O30 1 0.00000000 0.11478800 0.66196500 1.0 O O31 1 0.50000000 0.10877900 0.75767200 1.0 O O32 1 0.00000000 0.15029600 0.50773000 1.0 O O33 1 0.00000000 0.14630700 0.28971700 1.0 O O34 1 0.50000000 0.17757500 0.85764000 1.0 O O35 1 0.50000000 0.21285400 0.08602100 1.0 O O36 1 0.50000000 0.28714600 0.58602100 1.0 O O37 1 0.50000000 0.32242500 0.35764000 1.0 O O38 1 0.00000000 0.35369300 0.78971700 1.0 O O39 1 0.00000000 0.34970400 0.00773000 1.0 O O40 1 0.50000000 0.39122100 0.25767200 1.0 O O41 1 0.00000000 0.38521200 0.16196500 1.0 O O42 1 0.00000000 0.44727700 0.66009800 1.0 O O43 1 0.00000000 0.45800800 0.44163500 1.0 O O44 1 0.50000000 0.49538700 0.07922900 1.0 O O45 1 0.50000000 0.50461300 0.92077100 1.0 O O46 1 0.00000000 0.54199200 0.55836500 1.0 O O47 1 0.00000000 0.55272300 0.33990200 1.0 O O48 1 0.00000000 0.61478800 0.83803500 1.0 O O49 1 0.50000000 0.60877900 0.74232800 1.0 O O50 1 0.00000000 0.65029600 0.99227000 1.0 O O51 1 0.00000000 0.64630700 0.21028300 1.0 O O52 1 0.50000000 0.67757500 0.64236000 1.0 O O53 1 0.50000000 0.71285400 0.41397900 1.0 O O54 1 0.50000000 0.78714600 0.91397900 1.0 O O55 1 0.50000000 0.82242500 0.14236000 1.0 O O56 1 0.00000000 0.85369300 0.71028300 1.0 O O57 1 0.00000000 0.84970400 0.49227000 1.0 O O58 1 0.50000000 0.89122100 0.24232800 1.0 O O59 1 0.00000000 0.88521200 0.33803500 1.0 O O60 1 0.00000000 0.94727700 0.83990200 1.0 O O61 1 0.00000000 0.95800800 0.05836500 1.0