data_/home/k0475/k047502/DTSPs/030/DensestPackings/0.300000-0.460000-1.000000/4-3-1/CifFiles/0.784074.cif
_audit_creation_date              Sun Aug 29 19:48:37 2021

_audit_creation_method            'SAMLAI'
_symmetry_space_group_name_H-M    'P1'
_symmetry_Int_Tables_number       1
_symmetry_cell_setting            triclinic
loop_
_symmetry_equiv_pos_as_xyz
  x,y,z
_cell_length_a               2.10170981653
_cell_length_b               2.02712008699
_cell_length_c               2.02712008699
_cell_angle_alpha            120
_cell_angle_beta             90
_cell_angle_gamma            90
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_Uiso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
A1   Na  0.78735874656  0.845354662436  0.502400653812   0   Uiso   1
A2   H  0.0180939762258  0.0120213291027  0.835733987145   0   Uiso   1
A3   Na  0.78735874656  0.345354662436  0.00240065381171   0   Uiso   1
A4   H  0.0180939762258  0.678687995769  0.169067320478   0   Uiso   1
A5   H  0.556623516893  0.678687995769  0.169067320478   0   Uiso   1
A6   Sc  0.28735874656  0.345354662436  0.502400653812   0   Uiso   1
A7   H  0.556623516893  0.0120213291027  0.835733987145   0   Uiso   1
A8   Na  0.78735874656  0.845354662436  0.00240065381163   0   Uiso   1
