# generated using pymatgen
data_K3TiCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.61351200
_cell_length_b   14.47555500
_cell_length_c   14.83678775
_cell_angle_alpha   67.95632105
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3TiCl6
_chemical_formula_sum   'K12 Ti4 Cl24'
_cell_volume   1316.55559190
_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
  K  K0  1  0.01396100  0.06707300  0.74243100  1.0
  K  K1  1  0.51684800  0.68505300  0.37545500  1.0
  K  K2  1  0.95602100  0.30889600  0.85452900  1.0
  K  K3  1  0.01684800  0.81494700  0.62454500  1.0
  K  K4  1  0.51396100  0.43292700  0.25756900  1.0
  K  K5  1  0.45602100  0.19110400  0.14547100  1.0
  K  K6  1  0.54397900  0.80889600  0.85452900  1.0
  K  K7  1  0.98603900  0.93292700  0.25756900  1.0
  K  K8  1  0.04397900  0.69110400  0.14547100  1.0
  K  K9  1  0.48315200  0.31494700  0.62454500  1.0
  K  K10  1  0.48603900  0.56707300  0.74243100  1.0
  K  K11  1  0.98315200  0.18505300  0.37545500  1.0
  Ti  Ti12  1  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti13  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti14  1  0.50000000  0.00000000  0.50000000  1.0
  Ti  Ti15  1  0.00000000  0.50000000  0.50000000  1.0
  Cl  Cl16  1  0.65948500  0.11039500  0.85865500  1.0
  Cl  Cl17  1  0.93255200  0.14878200  0.18316100  1.0
  Cl  Cl18  1  0.51891400  0.83252700  0.63536700  1.0
  Cl  Cl19  1  0.32943700  0.91895100  0.40631700  1.0
  Cl  Cl20  1  0.01891400  0.66747300  0.36463300  1.0
  Cl  Cl21  1  0.17056300  0.41895100  0.40631700  1.0
  Cl  Cl22  1  0.30671000  0.53624500  0.56157000  1.0
  Cl  Cl23  1  0.84051500  0.61039500  0.85865500  1.0
  Cl  Cl24  1  0.74339300  0.38604700  0.01813600  1.0
  Cl  Cl25  1  0.34051500  0.88960500  0.14134500  1.0
  Cl  Cl26  1  0.82943700  0.58104900  0.59368300  1.0
  Cl  Cl27  1  0.48108600  0.16747300  0.36463300  1.0
  Cl  Cl28  1  0.69329000  0.46375500  0.43843000  1.0
  Cl  Cl29  1  0.80671000  0.96375500  0.43843000  1.0
  Cl  Cl30  1  0.75660700  0.88604700  0.01813600  1.0
  Cl  Cl31  1  0.98108600  0.33252700  0.63536700  1.0
  Cl  Cl32  1  0.15948500  0.38960500  0.14134500  1.0
  Cl  Cl33  1  0.25660700  0.61395300  0.98186400  1.0
  Cl  Cl34  1  0.56744800  0.64878200  0.18316100  1.0
  Cl  Cl35  1  0.43255200  0.35121800  0.81683900  1.0
  Cl  Cl36  1  0.67056300  0.08104900  0.59368300  1.0
  Cl  Cl37  1  0.19329000  0.03624500  0.56157000  1.0
  Cl  Cl38  1  0.06744800  0.85121800  0.81683900  1.0
  Cl  Cl39  1  0.24339300  0.11395300  0.98186400  1.0