#*********************************************************************************<br>
#<br>
# Crystallographic Information File for Li-LSX <br>
#<br>
# Reference : <br>
#   Feuerstein, M. and Lobo, R.F.<br>
#   Chem. Mater., , 2197-2204, (1998)<br>
#<br>
#<br>
# CIF downloaded from the IZA-SC Database of Zeolite Structures<br>
# Ch. Baerlocher, L.B. McCusker and D.H. Brouwer<br>
# Database of Zeolite Structures: https://www.iza-structure.org/databases/ <br>
#<br>
#**********************************************************************************<br>


data_Li-LSX<br>
_chemical_name_systematic 'Li-LSX'<br><br>

_cell_length_a      25.6957<br>
_cell_length_b      25.6957<br>
_cell_length_c      25.6957 <br>
_cell_angle_alpha   90 <br>
_cell_angle_beta    90 <br>
_cell_angle_gamma   90<br>
_cell_formula_units_Z   1<br>

<br>_space_group.name_H-M_ref   'F d -3'<br>
_symmetry_space_group_name_H-M   'F d -3'<br>
_symmetry_space_group_name_Hall  '-F 2uv 2vw 3'<br>
_space_group.IT_number  203 <br>
_space_group.IT_coordinate_system_code  '2'<br>
<br>
 
 loop_<br>
_atom_site_label<br>
_atom_site_type_symbol<br>
_atom_site_fract_x<br>
_atom_site_fract_y<br>
_atom_site_fract_z<br>
_atom_site_B_iso_or_equiv<br>
_atom_site_occupancy<br>
Si1  Si  -0.048  0.1246  0.0376  1.5  1<br>
Al1  Al  -0.0511  0.0378  0.1224  1.5  1<br>
O1  O  -0.1045  0.0028  0.0972  2.13  1<br>
O2  O  0.0001  -0.0007  0.1533  2.13  1<br>
O3  O  -0.022  0.0724  0.0702  2.13  1<br>
O4  O  -0.0742  0.0812  0.1711  2.13  1<br>
Li1  Li  0.0466  0.0466  0.0466  4.58  0.978<br>
Li2  Li  0.2232  0.2232  0.2232  2.92  1.047<br>
Li3  Li  0.387  0.401  0.122  7.82  0.235<br>

# End of data for Li-LSX<br>