data_/home/i0005/i000501/DTSPs/DensestPackings/0.300000-0.450000-1.000000/4-4-2/CifFiles/0.775691.cif
_audit_creation_date              Fri Apr  2 11:55:10 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
_cell_length_b               2.09523552151
_cell_length_c               3.3542160168
_cell_angle_alpha            108.199621934
_cell_angle_beta             89.3630915829
_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  0.107374225373  0.557817807836  0.88098981488   0   Uiso   1
A2   H  0.619527493989  0.491849059185  0.229081301695   0   Uiso   1
A3   H  0.104118579154  0.885149693818  0.0556246027295   0   Uiso   1
A4   Na  0.871390916762  0.693839120748  0.153032440705   0   Uiso   1
A5   H  0.619527493989  0.971878043301  0.229081301695   0   Uiso   1
A6   Na  0.355689846833  0.68950356286  0.143876699483   0   Uiso   1
A7   Sc  0.115858239473  0.330274041958  0.425902283126   0   Uiso   1
A8   H  0.104118579154  0.405120709702  0.0556246027295   0   Uiso   1
A9   Na  0.61627184777  0.819180945168  0.403716089544   0   Uiso   1
A10   Sc  0.607787833671  0.046724711045  0.858803621299   0   Uiso   1
