# generated using pymatgen
data_Ca3TmV4O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28707275
_cell_length_b   7.50445801
_cell_length_c   5.44727430
_cell_angle_alpha   89.90675743
_cell_angle_beta   90.93271406
_cell_angle_gamma   89.65721435
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3TmV4O12
_chemical_formula_sum   'Ca3 Tm1 V4 O12'
_cell_volume   216.09658148
_cell_formula_units_Z   1
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  0.48551975  0.74831056  0.45006771  1.0
  Ca  Ca1  1  0.51452935  0.24951739  0.55174549  1.0
  Ca  Ca2  1  0.99302099  0.25035097  0.04322650  1.0
  Tm  Tm3  1  0.01192361  0.75050049  0.93853428  1.0
  V  V4  1  0.50376820  0.49990075  0.00229677  1.0
  V  V5  1  0.99662911  0.49708233  0.49753386  1.0
  V  V6  1  0.99587880  0.99972116  0.49668514  1.0
  V  V7  1  0.50122459  0.00241238  0.00141790  1.0
  O  O8  1  0.92058411  0.74605695  0.52928150  1.0
  O  O9  1  0.60004868  0.75409367  0.02017232  1.0
  O  O10  1  0.07766047  0.25546328  0.48102951  1.0
  O  O11  1  0.42925009  0.24475661  0.98367788  1.0
  O  O12  1  0.79389208  0.46376563  0.79368353  1.0
  O  O13  1  0.71238775  0.03948520  0.29771683  1.0
  O  O14  1  0.28900309  0.54789311  0.72131382  1.0
  O  O15  1  0.19973079  0.94807832  0.19724602  1.0
  O  O16  1  0.19416875  0.55185808  0.19985119  1.0
  O  O17  1  0.28381959  0.95288274  0.70847779  1.0
  O  O18  1  0.69709137  0.46149029  0.29039795  1.0
  O  O19  1  0.79986786  0.03638709  0.79564699  1.0