# generated using pymatgen
data_Ca7TmMn2N9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.04579306
_cell_length_b   6.13277754
_cell_length_c   9.10410134
_cell_angle_alpha   87.71485135
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7TmMn2N9
_chemical_formula_sum   'Ca14 Tm2 Mn4 N18'
_cell_volume   560.44502460
_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
  Ca  Ca0  1  0.93113360  0.43133428  0.17374309  1.0
  Ca  Ca1  1  0.08096703  0.24443738  0.50065987  1.0
  Ca  Ca2  1  0.25000000  0.08519311  0.79633295  1.0
  Ca  Ca3  1  0.43113360  0.56866572  0.82625691  1.0
  Ca  Ca4  1  0.58096703  0.75556262  0.49934013  1.0
  Ca  Ca5  1  0.57716376  0.06299636  0.82424219  1.0
  Ca  Ca6  1  0.92283624  0.06299636  0.82424219  1.0
  Ca  Ca7  1  0.42283624  0.93700364  0.17575781  1.0
  Ca  Ca8  1  0.41903297  0.24443738  0.50065987  1.0
  Ca  Ca9  1  0.07716376  0.93700364  0.17575781  1.0
  Ca  Ca10  1  0.91903297  0.75556262  0.49934013  1.0
  Ca  Ca11  1  0.06886640  0.56866572  0.82625691  1.0
  Ca  Ca12  1  0.75000000  0.91480689  0.20366705  1.0
  Ca  Ca13  1  0.56886640  0.43133428  0.17374309  1.0
  Tm  Tm14  1  0.75000000  0.26825812  0.44958383  1.0
  Tm  Tm15  1  0.25000000  0.73174188  0.55041617  1.0
  Mn  Mn16  1  0.25000000  0.32072377  0.06514948  1.0
  Mn  Mn17  1  0.75000000  0.46974886  0.73461886  1.0
  Mn  Mn18  1  0.75000000  0.67927623  0.93485052  1.0
  Mn  Mn19  1  0.25000000  0.53025114  0.26538114  1.0
  N  N20  1  0.39557219  0.23034492  0.98562524  1.0
  N  N21  1  0.25000000  0.22909012  0.26077919  1.0
  N  N22  1  0.91840508  0.10085318  0.33395034  1.0
  N  N23  1  0.60882271  0.38139176  0.64839181  1.0
  N  N24  1  0.75000000  0.57399111  0.33083893  1.0
  N  N25  1  0.25000000  0.62240052  0.07030457  1.0
  N  N26  1  0.89117729  0.38139176  0.64839181  1.0
  N  N27  1  0.39117729  0.61860824  0.35160819  1.0
  N  N28  1  0.75000000  0.37759948  0.92969543  1.0
  N  N29  1  0.08159492  0.89914682  0.66604966  1.0
  N  N30  1  0.75000000  0.77090988  0.73922081  1.0
  N  N31  1  0.10882271  0.61860824  0.35160819  1.0
  N  N32  1  0.60442781  0.76965508  0.01437476  1.0
  N  N33  1  0.25000000  0.42600889  0.66916107  1.0
  N  N34  1  0.41840508  0.89914682  0.66604966  1.0
  N  N35  1  0.58159492  0.10085318  0.33395034  1.0
  N  N36  1  0.10442781  0.23034492  0.98562524  1.0
  N  N37  1  0.89557219  0.76965508  0.01437476  1.0