# generated using pymatgen
data_Cr3GaS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04158816
_cell_length_b   7.04158907
_cell_length_c   17.27135230
_cell_angle_alpha   89.99994762
_cell_angle_beta   90.00005302
_cell_angle_gamma   119.99990231
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3GaS6
_chemical_formula_sum   'Cr12 Ga4 S24'
_cell_volume   741.64948582
_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
  Cr  Cr0  1  0.16931246  0.83068805  0.21031107  1.0
  Cr  Cr1  1  0.84272501  0.15727361  0.54033233  1.0
  Cr  Cr2  1  0.50452570  0.49547375  0.87007614  1.0
  Cr  Cr3  1  0.16931223  0.33862417  0.21031107  1.0
  Cr  Cr4  1  0.84272808  0.68545396  0.54033167  1.0
  Cr  Cr5  1  0.50452606  0.00905118  0.87007611  1.0
  Cr  Cr6  1  0.33333356  0.66666661  0.03986772  1.0
  Cr  Cr7  1  -0.00000005  0.00000010  0.38425932  1.0
  Cr  Cr8  1  0.66666682  0.33333324  0.71341634  1.0
  Cr  Cr9  1  0.66137578  0.83068761  0.21031104  1.0
  Cr  Cr10  1  0.31454498  0.15727259  0.54033120  1.0
  Cr  Cr11  1  0.99094863  0.49547447  0.87007632  1.0
  Ga  Ga12  1  0.00000069  -0.00000068  0.99942470  1.0
  Ga  Ga13  1  0.66666781  0.33333229  0.33772840  1.0
  Ga  Ga14  1  0.33333463  0.66666606  0.66247426  1.0
  Ga  Ga15  1  0.66666581  0.33333427  0.08190824  1.0
  S  S16  1  0.17800863  0.82199126  0.95536356  1.0
  S  S17  1  0.84462243  0.15537720  0.28913477  1.0
  S  S18  1  0.51172625  0.48827306  0.62218931  1.0
  S  S19  1  0.17800871  0.35601729  0.95536340  1.0
  S  S20  1  0.84462244  0.68924457  0.28913479  1.0
  S  S21  1  0.51172609  0.02345283  0.62218920  1.0
  S  S22  1  0.33333358  0.66666626  0.79891538  1.0
  S  S23  1  -0.00000002  0.00000001  0.13397548  1.0
  S  S24  1  0.66666668  0.33333291  0.46790635  1.0
  S  S25  1  0.64398262  0.82199142  0.95536339  1.0
  S  S26  1  0.31075558  0.15537814  0.28913481  1.0
  S  S27  1  0.97654742  0.48827455  0.62218926  1.0
  S  S28  1  0.82209070  0.17790975  0.79531080  1.0
  S  S29  1  0.48822622  0.51177416  0.12738097  1.0
  S  S30  1  0.15566689  0.84433382  0.46102654  1.0
  S  S31  1  0.82209029  0.64418086  0.79531048  1.0
  S  S32  1  0.48822635  0.97645221  0.12738085  1.0
  S  S33  1  0.15566518  0.31133249  0.46102648  1.0
  S  S34  1  0.66666690  0.33333306  0.95012449  1.0
  S  S35  1  0.33333348  0.66666662  0.28231671  1.0
  S  S36  1  -0.00000023  -0.00000033  0.61763618  1.0
  S  S37  1  0.35581905  0.17790914  0.79531039  1.0
  S  S38  1  0.02354787  0.51177346  0.12738082  1.0
  S  S39  1  0.68866769  0.84433397  0.46102664  1.0