data_/home/koshoji/SAMLAIdsp/DTSPs/DensestPackings/0.200000-0.300000-1.000000/7-4-1/CifFiles/0.811218.cif
_audit_creation_date              Sat Mar 20 11:50:12 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               2.01410255736
_cell_length_b               2.00030671048
_cell_length_c               2
_cell_angle_alpha            106.311753017
_cell_angle_beta             59.7664701612
_cell_angle_gamma            120.238363167
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  0.194639139865  0.379369805498  0.540222442803   0   Uiso   1
A2   Na  0.194772944419  0.0648430809054  0.225632462162   0   Uiso   1
A3   H  0.938567169364  0.335449881404  0.209920611712   0   Uiso   1
A4   Na  0.428521226194  0.224374716295  0.380813942975   0   Uiso   1
A5   Sc  0.694706042142  0.722106443202  0.882927452482   0   Uiso   1
A6   H  0.941231553726  0.538678695768  0.206394228755   0   Uiso   1
A7   H  0.64725494696  0.106920849599  0.558433778725   0   Uiso   1
A8   Na  0.96089085809  0.219838170108  0.38504096199   0   Uiso   1
A9   H  0.742157137323  0.337292036804  0.20742112624   0   Uiso   1
A10   H  0.71334683028  0.221492946076  0.383545130006   0   Uiso   1
A11   H  0.448180498733  0.905534178324  0.559460777657   0   Uiso   1
A12   H  0.450844914919  0.108763004999  0.555934293252   0   Uiso   1
